SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
COc1cc(C)c(C(=O)N2CC(CO)(NC(=O)c3cc(O)nc(O)n3)C2)cn1
|
COcccC)cC=O)NCCCO))NC=O)cccO)ncO)n6))))))))C4)))))cn6
|
[C][O][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][O][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][C][O][=N][Ring1][Branch2][C][Ring1][P][C][=N][Ring2][Ring1][#Branch2]
|
c16cc(C)c9cn1.c18cc(O)nc(O)n1.N14CC7%10C1.C49=O.C58=O.CO6.C%10O.N57
|
COC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@H]1C[C@@H](CNC(=O)[C@H]2Cc3cccc(C)c3O2)C1
|
COC=O)[C@@H]CC[C@@H]4C=O)N[C@H]C[C@@H]CNC=O)[C@H]CcccccC)c6O9))))))))))))C4
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][O][Ring1][#Branch2][C][Ring2][Ring1][C]
|
[C@H]19Cc2cccc(C)c2O1.[C@@H]1%10CC[C@@H]1%11.[C@H]18C[C@@H]%12C1.C4%10=O.C5%11=O.C69=O.CO4.N58.C7%12.N67
|
CCc1ncc(Cl)c(C(=O)N[C@@H]2CN(C(=O)C=C(C)C3CC3)[C@H]3C[C@H]23)n1
|
CCcnccCl)cC=O)N[C@@H]CNC=O)C=CC)CCC3))))))[C@H]C[C@H]63))))))))n6
|
[C][C][C][=N][C][=C][Branch1][C][Cl][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][C][C][Ring1][Ring1][C@H1][C][C@H1][Ring1][=C][Ring1][Ring1][=N][Ring2][Ring1][Branch2]
|
c19ncc(Cl)c7n1.[C@@H]16CN5[C@H]2C[C@H]12.C=8(C)C1CC1.C5(=O)C=8.C47=O.CC9.N46
|
COc1ccc(Cl)c(C(=O)NC[C@@H]2COC[C@H]2NC(=O)[C@@H]2CCCN2C(C)=O)n1
|
COccccCl)cC=O)NC[C@@H]COC[C@H]5NC=O)[C@@H]CCCN5CC)=O)))))))))))))))))n6
|
[C][O][C][=C][C][=C][Branch1][C][Cl][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][Branch1][C][C][=O][=N][Ring2][Ring1][O]
|
c16ccc(Cl)c%10n1.[C@@H]1%11COC[C@H]18.[C@@H]19CCCN15.C3%10=O.C49=O.C5(C)=O.CO6.N37.C7%11.N48
|
CC(C)(C)SCC(=O)N[C@H]1CCCCC[C@@H]1NC(=O)[C@@]12CC=CCN1CCC2
|
CCC)C)SCC=O)N[C@H]CCCCC[C@@H]7NC=O)[C@@]CC=CCN6CCC9
|
[C][C][Branch1][C][C][Branch1][C][C][S][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C][C@@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@][C][C][=C][C][N][Ring1][=Branch1][C][C][C][Ring1][=Branch2]
|
[C@@]129CC=CCN1CCC2.[C@H]17CCCCC[C@@H]18.CC5(C)C.C6C3=O.C49=O.S56.N37.N48
|
C/C=C/C[C@H](C)C(=O)NC[C@H]1C[C@@H](NC(=O)c2cc(Br)cc(F)c2O)C1
|
C/C=C/C[C@H]C)C=O)NC[C@H]C[C@@H]NC=O)cccBr)ccF)c6O)))))))))C4
|
[C][/C][=C][/C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][Branch1][C][F][=C][Ring1][Branch2][O][C][Ring1][S]
|
c17cc(Br)cc(F)c1O.C=8C[C@H](C)C3=O.[C@H]19C[C@@H]6C1.C47=O.CC=8.N35.C59.N46
|
O=C(Nc1cc(F)cc(F)c1Cl)[C@H]1CCCCN1Cc1cccc(OC(F)F)c1
|
O=CNcccF)ccF)c6Cl))))))))[C@H]CCCCN6CcccccOCF)F)))c6
|
[O][=C][Branch1][P][N][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][Cl][C@H1][C][C][C][C][N][Ring1][=Branch1][C][C][=C][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring1][#Branch2]
|
c15cc(F)cc(F)c1Cl.[C@H]16CCCCN14.c17cccc3c1.O3C(F)F.O=C26.N25.C47
|
CC(C)[C@](C)(CNC(=O)[C@H](C)c1ccnn1C)NC(=O)c1coc(C(F)F)c1
|
CCC)[C@]C)CNC=O)[C@H]C)cccnn5C))))))))))NC=O)ccocCF)F))c5
|
[C][C][Branch1][C][C][C@][Branch1][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=C][C][=N][N][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][=Branch1][C][Branch1][C][F][F][=C][Ring1][Branch2]
|
CC(C)[C@]4(C)C5.c17ccnn1C.c16coc8c1.C2(=O)[C@@H]7C.C36=O.C8(F)F.N25.N34
|
CN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCN(C(=O)C2(OCc3ccccc3)CC2)C1
|
CNC=O)[C@@H]CC3F)F)))))[C@H]CCNC=O)COCcccccc6))))))))CC3))))C5
|
[C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][O][C][Ring2][Ring1][C]
|
[C@H]18CCN5C1.c1%11ccccc1.[C@@H]19CC1(F)F.C16%10CC1.CN48.C49=O.C5%10=O.O67.C7%11
|
CC[C@](C)(OC)C(=O)NC[C@@]1(OC)CCN(C(=O)CC[S@@+](C)[O-])C1
|
CC[C@]C)OC))C=O)NC[C@@]OC))CCNC=O)CC[S@@+]C)[O-])))))C5
|
[C][C][C@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C@@][Branch1][Ring1][O][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][S@@+1][Branch1][C][C][O-1][C][Ring1][=C]
|
CC[C@@]4(C)C2=O.[C@@]157CCN3C1.C3(=O)CC[S@@+](C)[O-].O4C.N26.C67.O5C
|
Cn1c(O)nc(N2CCC[C@H]2CCCNC(=O)CNC(=O)C2CC2)cc1=O
|
CncO)ncNCCC[C@H]5CCCNC=O)CNC=O)CCC3))))))))))))))))cc6=O
|
[C][N][C][Branch1][C][O][=N][C][Branch2][Ring1][O][N][C][C][C][C@H1][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][=C][C][Ring2][Ring1][=Branch2][=O]
|
Cn1c(O)nc7cc1=O.N17CCC[C@H]19.C9CC5.C3(=O)C6.C48=O.C18CC1.N35.N46
|
CNC(=O)C1(C(=O)NC[C@H](F)C2CCN(C(=O)[C@H]3CCC34CCC4)CC2)CCC1
|
CNC=O)CC=O)NC[C@H]F)CCCNC=O)[C@H]CCC4CCC4))))))))CC6))))))))))CCC4
|
[C][N][C][=Branch1][C][=O][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][F][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][C][C][C][Ring1][Ring2][C][C][C][Ring1][Ring2][C][C][Ring1][#C][C][C][C][Ring2][Ring1][=Branch2]
|
C1%12CCN7CC1.[C@H]1%11CCC12CCC2.C19%10CCC1.C8[C@@H]%12F.C59=O.C6%10=O.C7%11=O.CN5.N68
|
CC[C@](C)(OC)C(=O)NC[C@H](NC(=O)Cn1nc2ccccn2c1=O)C(C)(C)C
|
CC[C@]C)OC))C=O)NC[C@H]NC=O)Cnncccccn6c9=O)))))))))))))CC)C)C
|
[C][C][C@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][N][=C][C][=C][C][=C][N][Ring1][=Branch1][C][Ring1][=Branch2][=O][C][Branch1][C][C][Branch1][C][C][C]
|
n18nc2ccccn2c1=O.CC[C@@]5(C)C3=O.C6[C@H]7C(C)(C)C.C4(=O)C8.O5C.N36.N47
|
Cc1[nH]nc(C(=O)NCc2cccc(NC(=O)C3CC4(CCOC4)C3)c2)c1Cl
|
Cc[nH]ncC=O)NCcccccNC=O)CCCCCOC5))))C4))))))c6)))))))))c5Cl
|
[C][C][NH1][N][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][Branch1][#Branch1][C][C][O][C][Ring1][Branch1][C][Ring1][Branch2][=C][Ring1][P][C][=Ring2][Ring1][#Branch2][Cl]
|
C1%10CC2(CCOC2)C1.Cc1[nH]nc9c1Cl.c1%11cccc8c1.C59=O.C6%10=O.N57.C7%11.N68
|
CC[C@@H]1OCC[C@@H]1C(=O)N[C@H](CNC(=O)c1occc1Br)C(C)C
|
CC[C@@H]OCC[C@@H]5C=O)N[C@H]CNC=O)coccc5Br)))))))))CC)C
|
[C][C][C@@H1][O][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][Br][C][Branch1][C][C][C]
|
[C@@H]18OCC[C@@H]17.[C@@H]4(C5)C(C)C.c16occc1Br.C27=O.C36=O.CC8.N24.N35
|
C[C@@H](CNC(=O)c1nccc2[nH]ccc12)CC(=O)NCCCC(F)(F)F
|
C[C@@H]CNC=O)cnccc[nH]ccc95))))))))))))CC=O)NCCCCF)F)F
|
[C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
c17nccc2[nH]ccc12.C[C@@H](C5)CC4=O.C6CCC(F)(F)F.C37=O.N35.N46
|
CCO[C@@H](CC(=O)N1CC(N(C)C(=O)[C@H]2C[C@@H](S(C)(=O)=O)C2)C1)C1=CCCC1
|
CCO[C@@H]CC=O)NCCNC)C=O)[C@H]C[C@@H]SC)=O)=O))C4))))))C4))))))C=CCCC5
|
[C][C][O][C@@H1][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][Branch2][C][Ring1][S][C][=C][C][C][C][Ring1][Branch1]
|
[C@H]6(CC3=O)C1=CCCC1.[C@H]18C[C@@H](S(C)(=O)=O)C1.N13CC7C1.N47C.C48=O.CC5.O56
|
CCO[C@@H]1CCN(S(=O)(=O)c2ccc(N3C[C@@H]4C[C@H]4C3)c(C#N)c2)C[C@H]1C
|
CCO[C@@H]CCNS=O)=O)ccccNC[C@@H]C[C@H]3C6))))))cC#N))c6)))))))C[C@H]6C
|
[C][C][O][C@@H1][C][C][N][Branch2][Ring1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][O][N][C][C@@H1][C][C@H1][Ring1][Ring1][C][Ring1][=Branch1][C][Branch1][Ring1][C][#N][=C][Ring1][=C][C][C@H1][Ring2][Ring1][#Branch1][C]
|
S7(=O)(=O)c1ccc8c(C#N)c1.[C@@H]16CCN7C[C@H]1C.N18C[C@@H]2C[C@H]2C1.CC5.O56
|
C=C(F)CN=c1ccn2ncc(S(=O)(=O)NCCc3nncn3C)c2[nH]1
|
C=CF)CN=cccnnccS=O)=O)NCCcnncn5C))))))))))c5[nH]9
|
[C][=C][Branch1][C][F][C][N][=C][C][=C][N][N][=C][C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][=N][N][=C][N][Ring1][Branch1][C][=C][Ring1][P][NH1][Ring2][Ring1][Branch1]
|
C=C(F)CN=c1ccn2ncc(S5(=O)=O)c2[nH]1.c16nncn1C.C4C6.N45
|
CCCOCCC(=O)N[C@@H]1CN(C(=O)[C@@H](C)C(F)(F)C(F)F)C(CC)(CC)C1
|
CCCOCCC=O)N[C@@H]CNC=O)[C@@H]C)CF)F)CF)F)))))CCC))CC))C5
|
[C][C][C][O][C][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][Ring2][Ring1][Ring1]
|
C3(=O)[C@@H](C)C(F)(F)C(F)F.[C@@H]16CN3C78C1.C5CC2=O.CCC4.O45.N26.C7C.C8C
|
Cc1sc(C(=O)N(C)C[C@H](C)N(C)C(=O)CCC2CCC(O)CC2)nc1O
|
CcscC=O)NC)C[C@H]C)NC)C=O)CCCCCCO)CC6))))))))))))))nc5O
|
[C][C][S][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][=N][C][=Ring2][Ring1][=Branch2][O]
|
Cc1sc7nc1O.C18CCC(O)CC1.C4(=O)CC8.C5[C@@H]6C.C37=O.N35C.N46C
|
C[C@@H](NC(=O)CCn1cc(C2(F)COC2)nn1)C1(N2CCOCC2)CCCC1
|
C[C@@H]NC=O)CCnccCF)COC4))))nn5)))))))))CNCCOCC6))))))CCCC5
|
[C][C@@H1][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][#Branch2][C][Branch1][C][F][C][O][C][Ring1][Branch1][N][=N][Ring1][#Branch2][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][C][C][C][Ring1][O]
|
n16cc8nn1.C157CCCC1.N15CCOCC1.C3(=O)CC6.C18(F)COC1.C[C@@H]47.N34
|
CSc1cc(C)c(C(=O)N2CC[C@@](C)(CNC(=O)CC(=O)OC(C)(C)C)C2)o1
|
CScccC)cC=O)NCC[C@@]C)CNC=O)CC=O)OCC)C)C))))))))C5))))))o5
|
[C][S][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][C][O][Ring2][Ring1][#Branch2]
|
c1%10cc(C)c8o1.N14CC[C@]9(C)C1.C5(=O)CC3=O.C6(C)(C)C.C48=O.CS%10.C79.N57.O36
|
Cc1cc(C(=O)NCC(C)(C)OCCNC(=O)[C@@H](F)C(C)(C)O)c(N)s1
|
CcccC=O)NCCC)C)OCCNC=O)[C@@H]F)CC)C)O))))))))))))cN)s5
|
[C][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][C][Branch1][C][C][O][=C][Branch1][C][N][S][Ring2][Ring1][=Branch2]
|
C3(=O)[C@@H](F)C(C)(C)O.Cc1cc8c(N)s1.C6C4(C)C.C28=O.C5C7.N26.O45.N37
|
CCCC[C@@H](CC(=O)OCC)NC(=O)[C@@H]1CCCN(C[C@@H](O)CO)CC1
|
CCCC[C@@H]CC=O)OCC)))))NC=O)[C@@H]CCCNC[C@@H]O)CO))))CC7
|
[C][C][C][C][C@@H1][Branch1][=Branch2][C][C][=Branch1][C][=O][O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Branch1][Branch2][C][C@@H1][Branch1][C][O][C][O][C][C][Ring1][N]
|
CCCC[C@H]5CC2=O.[C@@H]17CCCN6CC1.C6[C@@H](O)CO.C37=O.O24.C4C.N35
|
O=C(Nc1cc(Br)cnc1Br)c1ncc(-c2cc3sccc3s2)cn1
|
O=CNcccBr)cnc6Br))))))))cncc-cccsccc5s8))))))))cn6
|
[O][=C][Branch1][=C][N][C][=C][C][Branch1][C][Br][=C][N][=C][Ring1][#Branch1][Br][C][=N][C][=C][Branch1][=N][C][=C][C][S][C][=C][C][=Ring1][Branch1][S][Ring1][Branch2][C][=N][Ring1][=C]
|
c15cc(Br)cnc1Br.c17cc2sccc2s1.c16ncc7cn1.O=C46.N45
|
C[C@@H]1CCN(C(=O)c2ccc(Cl)s2)C[C@H]1CC(=O)N(CCO)C1CCCCC1
|
C[C@@H]CCNC=O)ccccCl)s5))))))C[C@H]6CC=O)NCCO)))CCCCCC6
|
[C][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1][C][C@H1][Ring1][=C][C][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C][C][C][C][C][C][Ring1][=Branch1]
|
C[C@@H]1CCN3C[C@H]18.c17ccc(Cl)s1.C16CCCCC1.C8C4=O.C37=O.N456.C5CO
|
Cc1ccc(OCCC(=O)NC[C@H]2CCCCN2C(=O)c2cccc(O)n2)cc1
|
CccccOCCC=O)NC[C@H]CCCCN6C=O)cccccO)n6)))))))))))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring1][P][O][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=N][Ring1][#Branch1][C][=C][Ring2][Ring1][N]
|
Cc1ccc6cc1.[C@H]19CCCCN14.c18cccc(O)n1.C5CC3=O.C48=O.O56.N37.C79
|
CCN(CCNC(=O)[C@@H](C)OC1CCCC1)C(=O)Cc1cc(S(N)(=O)=O)cn1C
|
CCNCCNC=O)[C@@H]C)OCCCCC5)))))))))))C=O)CcccSN)=O)=O))cn5C
|
[C][C][N][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][N][Ring1][=Branch2][C]
|
c19cc(S(N)(=O)=O)cn1C.C2(=O)[C@H]4C.C15CCCC1.C3(=O)C9.N367.C7C8.CC6.N28.O45
|
CCOC1CC(CC(=O)NC[C@@H](N=c2[nH]nc(C)o2)c2ccc(N(C)C)cc2)C1
|
CCOCCCCC=O)NC[C@@H]N=c[nH]ncC)o5))))))ccccNC)C))cc6)))))))))))C4
|
[C][C][O][C][C][C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][N][N][=C][NH1][N][=C][Branch1][C][C][O][Ring1][=Branch1][C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][=Branch2][C][Ring2][Ring1][#Branch2]
|
C6[C@H]9N=c1[nH]nc(C)o1.c19ccc7cc1.C15CC8C1.C8C3=O.N7(C)C.CC4.O45.N36
|
C[C@H](CN(C)C(=O)c1cc(F)c(F)c(F)c1)NC(=O)[C@@H](C)NC(=O)OC(C)(C)C
|
C[C@H]CNC)C=O)cccF)cF)cF)c6)))))))))NC=O)[C@@H]C)NC=O)OCC)C)C
|
[C][C@H1][Branch2][Ring1][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
c1%10cc(F)c(F)c(F)c1.C4(=O)[C@H]9C.C[C@@H]7C8.C6(C)(C)C.N38C.C3%10=O.C25=O.N47.N59.O26
|
Cc1nn(C)c(=O)c(C(=O)NC[C@]2(F)C[C@@H](CNC(=O)[C@@]34CCC[C@@H]3C4)C2)c1C
|
CcnnC)c=O)cC=O)NC[C@]F)C[C@@H]CNC=O)[C@@]CCC[C@@H]5C6)))))))))C4)))))))c6C
|
[C][C][=N][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@][C][C][C][C@@H1][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][#C][=C][Ring2][Ring1][O][C]
|
Cc1nn(C)c(=O)c%10c1C.[C@]1%11(F)C[C@H]%12C1.[C@@]129CCC[C@@H]1C2.C5%10=O.C69=O.N57.C7%11.C8%12.N68
|
N#Cc1ccc(C(=O)NCc2cn(-c3ccc(F)cn3)nn2)cc1Cl
|
N#CccccC=O)NCccn-ccccF)cn6))))))nn5))))))))cc6Cl
|
[N][#C][C][=C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][=C][N][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][N][=N][Ring1][N][C][=C][Ring2][Ring1][=Branch1][Cl]
|
N#Cc1ccc6cc1Cl.c18ccc(F)cn1.c17cn8nn1.C46=O.N45.C57
|
CCN(CC)C[C@@H](F)C(=O)N1CC(CNC(=O)c2c(Cl)nn(C)c2C)C1
|
CCNCC))C[C@@H]F)C=O)NCCCNC=O)ccCl)nnC)c5C)))))))))C4
|
[C][C][N][Branch1][Ring1][C][C][C][C@@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][Branch1][C][Cl][=N][N][Branch1][C][C][C][=Ring1][#Branch1][C][C][Ring1][S]
|
c19c(Cl)nn(C)c1C.C7[C@@H](F)C3=O.N13CC%10C1.N567.C49=O.CC5.C6C.C8%10.N48
|
CSCCC(=O)N1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CCC(C)(C)C)C2
|
CSCCC=O)N[C@@H]CC[C@H]5[C@H]NC=O)[C@@H]C)CCCC)C)C)))))))C6
|
[C][S][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][P]
|
C4(=O)[C@@H](C)CCC(C)(C)C.N13[C@@H]2CC[C@H]1[C@H]6C2.C5CC3=O.CS5.N46
|
O=C1CC(C(=O)N2CC[C@H]3[C@H](CCCN3C(=O)Cc3cncc(O)c3)C2)=NN1
|
O=CCCC=O)NCC[C@H][C@H]CCCN6C=O)CccnccO)c6))))))))))))C6)))))))=NN5
|
[O][=C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@H1][C@H1][Branch2][Ring1][#Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][N][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][Ring2][Ring1][Ring2][=N][N][Ring2][Ring1][O]
|
N14CC[C@H]2[C@H](CCCN25)C1.O=C1CC(C4=O)=NN1.c16cncc(O)c1.C5(=O)C6
|
C[C@H](CCCNC(=O)c1ccc2c(c1)COC2)NC(=O)C1C(C)(C)OC1(C)C
|
C[C@H]CCCNC=O)cccccc6)COC5)))))))))))))NC=O)CCC)C)OC4C)C
|
[C][C@H1][Branch2][Ring1][Branch2][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][O][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][=Branch1][Branch1][C][C][C]
|
c18ccc2c(c1)COC2.C17C(C)(C)OC1(C)C.C[C@@H]5CCC6.C38=O.C47=O.N36.N45
|
Cc1ccc(SCC(=O)N2CC[C@@H](N(CCO)C(=O)C[C@H](C)P(C)(C)=O)C2)cc1
|
CccccSCC=O)NCC[C@@H]NCCO)))C=O)C[C@H]C)PC)C)=O))))))C5))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][=Branch2][S][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch2][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][P][Branch1][C][C][Branch1][C][C][=O][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][N]
|
C4(=O)C[C@H](C)P(C)(C)=O.Cc1ccc8cc1.N13CC[C@@H]7C1.C6C3=O.N457.C5CO.S68
|
O=C([C@@H]1[C@H]2CC[C@H](C2)N1Cc1cc(Cl)cc(C(F)(F)F)c1)N1CCCC(F)(F)C1
|
O=C[C@@H][C@H]CC[C@H]C5)N6CcccCl)ccCF)F)F))c6)))))))))))))NCCCCF)F)C6
|
[O][=C][Branch2][Ring2][Ring2][C@@H1][C@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][Branch1][N][Ring1][#Branch1][C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2]
|
[C@@H]15[C@H]2CC[C@H](C2)N14.c16cc7cc(Cl)c1.N13CCCC(F)(F)C1.C7(F)(F)F.O=C35.C46
|
C[C@H](NC(=O)C(C)(C)[C@@H]1CCCCO1)[C@H]1CCCN1C(=O)CNS(N)(=O)=O
|
C[C@H]NC=O)CC)C)[C@@H]CCCCO6)))))))))[C@H]CCCN5C=O)CNSN)=O)=O
|
[C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][C][C][O][Ring1][=Branch1][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][S][Branch1][C][N][=Branch1][C][=O][=O]
|
C2(=O)C7(C)C.[C@@H]17CCCCO1.[C@H]16CCCN13.N5S(N)(=O)=O.C3(=O)C5.C[C@H]46.N24
|
CC[C@]1(CNC(=O)[C@@]23CCOC[C@H]2C3(F)F)COC(=O)C1
|
CC[C@]CNC=O)[C@@]CCOC[C@H]6C7F)F)))))))))))COC=O)C5
|
[C][C][C@][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@][C][C][O][C][C@H1][Ring1][=Branch1][C][Ring1][#Branch1][Branch1][C][F][F][C][O][C][=Branch1][C][=O][C][Ring2][Ring1][Ring1]
|
[C@@]126CCOC[C@H]1C2(F)F.[C@@]178COC(=O)C1.C46=O.CC7.C58.N45
|
C[C@H](NC(=O)C[C@H]1CCCO1)C1(O)CN(C(=O)c2cnc3c(cnn3C)c2)C1
|
C[C@H]NC=O)C[C@H]CCCO5))))))))CO)CNC=O)ccncccnn5C))))c6)))))))C4
|
[C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][O][Ring1][Branch1][C][Branch1][C][O][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][#Branch1][C][=N][N][Ring1][Branch1][C][=C][Ring1][#Branch2][C][Ring1][P]
|
c17cnc2c(cnn2C)c1.C19(O)CN5C1.[C@H]18CCCO1.C4(=O)C8.C[C@H]69.C57=O.N46
|
CCCc1nc(-c2nc(-c3cccc(Cl)n3)nn2[C@@H](C)C(F)(F)F)co1
|
CCCcnc-cnc-cccccCl)n6))))))nn5[C@@H]C)CF)F)F))))))))co5
|
[C][C][C][C][=N][C][Branch2][Ring1][P][C][=N][C][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=N][Ring1][#Branch1][=N][N][Ring1][N][C@@H1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F][=C][O][Ring2][Ring1][#Branch1]
|
c16nc7nn14.c17cccc(Cl)n1.c15nc6co1.[C@H]4(C)C(F)(F)F.CCC5
|
COC(=O)[C@@H]1CC[C@H](C(=O)N2C[C@H](NC(=O)c3cccs3)[C@@H]3CCCC[C@H]32)C1
|
COC=O)[C@@H]CC[C@H]C=O)NC[C@H]NC=O)ccccs5)))))))[C@@H]CCCC[C@H]69))))))))))C5
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][Ring1][P][C][Ring2][Ring1][Branch2]
|
N15C[C@H]7[C@@H]2CCCC[C@H]21.[C@@H]19CC[C@H]%10C1.c18cccs1.C49=O.C5%10=O.C68=O.CO4.N67
|
Cc1cc(-c2cn(-c3cccc(Br)c3F)nn2)cnc1C(=O)N[C@H](C)C(=O)O
|
Cccc-ccn-cccccBr)c6F)))))))nn5)))))cnc6C=O)N[C@H]C)C=O)O
|
[C][C][=C][C][Branch2][Ring1][=Branch1][C][=C][N][Branch1][=N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][F][N][=N][Ring1][=N][=C][N][=C][Ring2][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][O]
|
Cc1cc8cnc16.c17cccc(Br)c1F.c18cn7nn1.[C@@H]5(C)C(=O)O.C46=O.N45
|
CCN1CCCC[C@H]1C(=O)NC[C@@H](O)CNC(=O)c1ccc(-n2cnnc2)cc1
|
CCNCCCC[C@H]6C=O)NC[C@@H]O)CNC=O)cccc-ncnnc5)))))cc6
|
[C][C][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][=N][N][=C][Ring1][Branch1][C][=C][Ring1][O]
|
N15CCCC[C@H]18.c19ccc%10cc1.C6[C@@H](O)C7.n1%10cnnc1.C38=O.C49=O.CC5.N36.N47
|
C[C@@H]1COC[C@H](C(=O)N2CC[C@@H](C)[C@@H](CC(=O)N(C)[C@H]3C[C@@H](C(N)=O)C3)C2)O1
|
C[C@@H]COC[C@H]C=O)NCC[C@@H]C)[C@@H]CC=O)NC)[C@H]C[C@@H]CN)=O))C4)))))))C6)))))))O6
|
[C][C@@H1][C][O][C][C@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C@@H1][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C@@H1][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring1][#Branch1][C][Ring2][Ring1][Ring1][O][Ring2][Ring1][O]
|
N14CC[C@@H](C)[C@@H]9C1.C[C@@H]1COC[C@H]7O1.[C@H]16C[C@@H]8C1.C9C5=O.C47=O.N56C.C8(N)=O
|
Cc1cc(C#N)cnc1N1CCC(C[C@H](C)NC(=O)[C@@H](C)c2cccnc2)CC1
|
CcccC#N))cnc6NCCCC[C@H]C)NC=O)[C@@H]C)ccccnc6)))))))))))CC6
|
[C][C][=C][C][Branch1][Ring1][C][#N][=C][N][=C][Ring1][Branch2][N][C][C][C][Branch2][Ring1][#Branch1][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring2]
|
Cc1cc(C#N)cnc15.N15CCC6CC1.c17cccnc1.C3(=O)[C@H]7C.C6[C@@H]4C.N34
|
Cc1ccnc(C)c1C(=O)NCCC[C@@H]1CN(C(=O)[C@H]2CCCC2(C)C)CCO1
|
CcccncC)c6C=O)NCCC[C@@H]CNC=O)[C@H]CCCC5C)C)))))))CCO6
|
[C][C][=C][C][=N][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][C][C][C][C][Ring1][Branch1][Branch1][C][C][C][C][C][O][Ring1][#C]
|
Cc1ccnc(C)c17.[C@@H]18CN4CCO1.[C@H]16CCCC1(C)C.C5CC8.C37=O.C46=O.N35
|
COc1c(C(=O)N2CC[C@H]3CC[C@@H](NC(=O)c4cc(C)co4)[C@H]2C3)cnn1C
|
COccC=O)NCC[C@H]CC[C@@H]NC=O)cccC)co5)))))))[C@H]8C6))))))))))cnn5C
|
[C][O][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][O][Ring1][=Branch1][C@H1][Ring1][P][C][Ring1][#C][C][=N][N][Ring2][Ring1][=Branch2][C]
|
N15CC[C@H]2CC[C@@H]8[C@H]1C2.c17c%10cnn1C.c19cc(C)co1.C5%10=O.C69=O.CO7.N68
|
Brc1cc(Br)c2oc(CNc3cccnc3-c3ccccc3)cc2c1
|
BrcccBr)cocCNccccnc6-cccccc6))))))))))))))cc5c9
|
[Br][C][=C][C][Branch1][C][Br][=C][O][C][Branch2][Ring1][Ring1][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][Branch2]
|
Brc1cc(Br)c2oc6cc2c1.c15cccnc17.c17ccccc1.C46.N45
|
CN(C)[C@H](CO)C(=O)NC[C@H](NC(=O)c1cc(C(C)(C)C)no1)c1ccccc1
|
CNC)[C@H]CO))C=O)NC[C@H]NC=O)cccCC)C)C))no5)))))))cccccc6
|
[C][N][Branch1][C][C][C@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][O][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
[C@@H]4(CO)C2=O.c17cc8no1.c19ccccc1.C5[C@H]69.C8(C)(C)C.CN4C.C37=O.N25.N36
|
O=C(CCc1cn[nH]c1)NC[C@@]1(O)CCN(C(=O)CSc2cn[nH]c2)C1
|
O=CCCccn[nH]c5)))))))NC[C@@]O)CCNC=O)CSccn[nH]c5))))))))C5
|
[O][=C][Branch1][#Branch2][C][C][C][C][=N][NH1][C][=Ring1][Branch1][N][C][C@@][Branch1][C][O][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][S][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring1][#C]
|
[C@]17(O)CCN4C1.O=C3CC8.c18cn[nH]c1.c19cn[nH]c1.C4(=O)C6.N35.C57.S69
|
COC1(C(=O)N2CC[C@@](O)(CNC(=O)C3CN(S(C)(=O)=O)C3)C2)CCSCC1
|
COCC=O)NCC[C@@]O)CNC=O)CCNSC)=O)=O))C4)))))))C5))))))CCSCC6
|
[C][O][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][O][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][Branch2][C][Ring2][Ring1][C][C][C][S][C][C][Ring2][Ring1][#Branch2]
|
C169CCSCC1.N14CC[C@]%11(O)C1.C1%10CN8C1.S8(C)(=O)=O.C49=O.C5%10=O.CO6.C7%11.N57
|
CC(=O)NCC(=O)NC[C@H]1CCC[C@@H]1NC(=O)c1cnc2ncccn12
|
CC=O)NCC=O)NC[C@H]CCC[C@@H]5NC=O)ccncncccn96
|
[C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1]
|
c19cnc2ncccn12.[C@H]1%10CCC[C@@H]18.C6C4=O.CC3=O.C59=O.N36.N47.C7%10.N58
|
C=C(Br)CCC(=O)N(C)CCN(C)C(=O)c1c[nH]c(=O)cn1
|
C=CBr)CCC=O)NC)CCNC)C=O)cc[nH]c=O)cn6
|
[C][=C][Branch1][C][Br][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=O][C][=N][Ring1][#Branch1]
|
C=C(Br)CCC2=O.c16c[nH]c(=O)cn1.N24C.C4C5.N35C.C36=O
|
CC[C@@H](C)OCC(=O)N1CC[C@](CO)(C(=O)N2CCC(C)=C(C)C2)C1
|
CC[C@@H]C)OCC=O)NCC[C@]CO))C=O)NCCCC)=CC)C6)))))))C5
|
[C][C][C@@H1][Branch1][C][C][O][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][Ring1][C][O][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][=C][Branch1][C][C][C][Ring1][Branch2][C][Ring1][P]
|
N14CCC(C)=C(C)C1.N13CC[C@@]78C1.CC[C@H]5C.C6C3=O.C47=O.O56.C8O
|
COCCCn1c(-c2c(Cl)nc(Cl)n2C)nnc1N(C)CC1(OC)CCCC1
|
COCCCnc-ccCl)ncCl)n5C))))))nnc5NC)CCOC))CCCC5
|
[C][O][C][C][C][N][C][Branch1][#C][C][=C][Branch1][C][Cl][N][=C][Branch1][C][Cl][N][Ring1][#Branch1][C][=N][N][=C][Ring1][=N][N][Branch1][C][C][C][C][Branch1][Ring1][O][C][C][C][C][C][Ring1][#Branch1]
|
c19c(Cl)nc(Cl)n1C.n17c6nnc19.C148CCCC1.C3CC7.N56C.CO3.C58.O4C
|
CCN(C(=O)CC1CSC1)[C@H]1CCCN(C(=O)C[C@H]2CCCOC2)C1
|
CCNC=O)CCCSC4))))))[C@H]CCCNC=O)C[C@H]CCCOC6))))))))C6
|
[C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][S][C][Ring1][Ring2][C@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][#C]
|
[C@H]16CCCN4C1.[C@H]18CCCOC1.C3(=O)C7.C17CSC1.C4(=O)C8.N356.CC5
|
CCON(C(=O)C[C@@H]1CN(C(=O)C[C@H](C)n2cccc2)CC12CC2)C(C)C
|
CCONC=O)C[C@@H]CNC=O)C[C@H]C)ncccc5))))))))CC5CC3)))))))))CC)C
|
[C][C][O][N][Branch2][Ring2][Ring1][C][=Branch1][C][=O][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][N][C][=C][C][=C][Ring1][Branch1][C][C][Ring1][#C][C][C][Ring1][Ring1][C][Branch1][C][C][C]
|
O4N(C(=O)C6)C(C)C.[C@@H]16CN3CC12CC2.C3(=O)C[C@@H]5C.n15cccc1.CC4
|
C[C@@H]1C[C@H](C(=O)N2CCC[C@@H]2CCCNC(=O)C23CCCN2CCC3)CC(=O)N1
|
C[C@@H]C[C@H]C=O)NCCC[C@@H]5CCCNC=O)CCCCN5CCC8)))))))))))))))))))CC=O)N6
|
[C][C@@H1][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][C][C][Ring1][Branch2][C][C][=Branch1][C][=O][N][Ring2][Ring1][N]
|
C[C@@H]1C[C@H]8CC(=O)N1.C127CCCN1CCC2.N14CCC[C@@H]19.C9CC6.C48=O.C57=O.N56
|
O=C(CCC(CF)CF)NCC[C@]12CC[C@H]1CN(C(=O)c1cn3c(n1)CCC3)C2
|
O=CCCCCF))CF)))))NCC[C@]CC[C@H]4CNC=O)ccncn5)CCC5))))))))C7
|
[O][=C][Branch1][#Branch2][C][C][C][Branch1][Ring1][C][F][C][F][N][C][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C][C][Ring1][=Branch1][C][Ring1][P]
|
O=C4CCC(CF)CF.[C@]128CC[C@H]1CN5C2.c17cn2c(n1)CCC2.C6C8.C57=O.N46
|
CC1CC(C(=O)N2C[C@H](C)[C@H](NC(=O)c3cscc3Cl)C2)C1
|
CCCCC=O)NC[C@H]C)[C@H]NC=O)ccscc5Cl))))))))C5))))))C4
|
[C][C][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][Cl][C][Ring1][#C][C][Ring2][Ring1][Branch1]
|
N14C[C@@H]6[C@@H](C)C1.c18cscc1Cl.CC1CC7C1.C47=O.C58=O.N56
|
CNC(=O)N1CCC[C@@H]1C(=O)N[C@H]1CN(C(=O)/C=C/C(C)C)C(C)(C)C1
|
CNC=O)NCCC[C@@H]5C=O)N[C@H]CNC=O)/C=C/CC)C)))))CC)C)C5
|
[C][N][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][/C][=C][/C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=C]
|
[C@H]16CN5C(C)(C)C1.N13CCC[C@@H]17.C5(=O)C=8.C=8C(C)C.C23=O.C47=O.CN2.N46
|
CCC[C@@H](C(=O)N1CCC(C)(C)[C@H]1CNC(=O)[C@@H](NC(C)=O)[C@@H](C)CC)N(C)C
|
CCC[C@@H]C=O)NCCCC)C)[C@H]5CNC=O)[C@@H]NCC)=O)))[C@@H]C)CC)))))))))))))NC)C
|
[C][C][C][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@@H1][Branch1][C][C][C][C][N][Branch1][C][C][C]
|
N12CCC(C)(C)[C@H]18.C3(=O)[C@@H]7[C@@H](C)CC.CCC[C@H]5C2=O.C4(C)=O.N5(C)C.C68.N36.N47
|
CCOCCOCC(=O)N[C@H]1CCCC[C@H]1N(C)C(=O)C[C@@]1(C)CC1(Cl)Cl
|
CCOCCOCC=O)N[C@H]CCCC[C@H]6NC)C=O)C[C@@]C)CC3Cl)Cl
|
[C][C][O][C][C][O][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C@@][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][Cl][Cl]
|
[C@H]18CCCC[C@H]19.[C@]1%10(C)CC1(Cl)Cl.C7C2=O.C3(=O)C%10.C5C6.N39C.CC4.O45.O67.N28
|
C[C@@H](CNC(=O)CCC(=O)NC1CCCC1)CNC(=O)[C@@H](C)n1cccc1
|
C[C@@H]CNC=O)CCC=O)NCCCCC5))))))))))))CNC=O)[C@@H]C)ncccc5
|
[C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][=C][C][=C][Ring1][Branch1]
|
C2(=O)CCC3=O.C[C@@H](C5)C6.C17CCCC1.C4(=O)[C@H]8C.n18cccc1.N25.N37.N46
|
O=C(NCCNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccnn1[C@@H]1CC1(F)F
|
O=CNCCNC=O)[C@@H]C[C@H]3ccccF)cc6))))))))))))))cccnn5[C@@H]CC3F)F
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=N][N][Ring1][Branch1][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F]
|
c19ccc(F)cc1.c16ccnn18.[C@@H]18CC1(F)F.[C@@H]17C[C@H]19.O=C26.C4C5.C37=O.N24.N35
|
C[C@H](C(=O)N[C@H]1C[C@@H](CNC(=O)[C@]2(S(C)(=O)=O)COC(=O)C2)C1)c1ccco1
|
C[C@H]C=O)N[C@H]C[C@@H]CNC=O)[C@]SC)=O)=O))COC=O)C5))))))))C4))))))cccco5
|
[C][C@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][C@][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][O][C][=Branch1][C][=O][C][Ring1][#Branch2][C][Ring2][Ring1][C][C][=C][C][=C][O][Ring1][Branch1]
|
[C@@]17(S(C)(=O)=O)COC(=O)C1.C[C@@H]8C3=O.[C@H]16C[C@@H]9C1.c18ccco1.C47=O.N36.C59.N45
|
C[C@@H](C(=O)N1CCc2c(F)cccc21)C1CCN(C(=O)CCCCN(C)C)CC1
|
C[C@@H]C=O)NCCccF)cccc69))))))))))CCCNC=O)CCCCNC)C)))))))CC6
|
[C][C@@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][Ring1][#Branch2][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][N][Branch1][C][C][C][C][C][Ring1][#C]
|
N13CCc2c(F)cccc21.C16CCN4CC1.C4(=O)CCCC5.C[C@H]6C3=O.N5(C)C
|
CC(C)n1ccc(CC(=O)N2CC[C@H]([C@@H](C)NC(=O)c3cc(Cl)n[nH]3)C2)n1
|
CCC)ncccCC=O)NCC[C@H][C@@H]C)NC=O)cccCl)n[nH]5))))))))C5)))))))n5
|
[C][C][Branch1][C][C][N][C][=C][C][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][NH1][Ring1][=Branch1][C][Ring1][S][=N][Ring2][Ring1][Branch2]
|
n18ccc9n1.N14CC[C@H]%10C1.c17cc(Cl)n[nH]1.C9C4=O.CC8C.[C@H]6%10C.C57=O.N56
|
COc1ccccc1C1(C(=O)N2C[C@H]3C[C@@]3(C(C)C)C2)CC1
|
COcccccc6CC=O)NC[C@H]C[C@@]3CC)C))C6)))))))CC3
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@][Ring1][Ring1][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring1][=Branch2][C][C][Ring1][=C]
|
c15ccccc18.N14C[C@H]2C[C@@]27C1.C168CC1.C46=O.C7(C)C.CO5
|
CCO[C@@H]1CCN(N(C)Cc2c(C)nc3sc(C)cn23)C[C@@H]1C
|
CCO[C@@H]CCNNC)CccC)ncscC)cn85))))))))))C[C@@H]6C
|
[C][C][O][C@@H1][C][C][N][Branch2][Ring1][Branch2][N][Branch1][C][C][C][C][=C][Branch1][C][C][N][=C][S][C][Branch1][C][C][=C][N][Ring1][#Branch2][Ring1][=Branch1][C][C@@H1][Ring2][Ring1][Ring1][C]
|
[C@@H]15CCN(N(C)C6)C[C@@H]1C.c16c(C)nc2sc(C)cn12.CC4.O45
|
Cc1ccc(Br)c2cc(C(=O)NC[C@H](C)CN(C)C(=O)[C@@H](C)CF)[nH]c12
|
CccccBr)cccC=O)NC[C@H]C)CNC)C=O)[C@@H]C)CF))))))))))[nH]c95
|
[C][C][=C][C][=C][Branch1][C][Br][C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][F][NH1][C][Ring2][Ring1][=Branch2][=Ring2][Ring1][Ring2]
|
Cc1ccc(Br)c2cc7[nH]c12.C4(=O)[C@@H](C)CF.C5[C@H](C)C6.C37=O.N46C.N35
|
COc1ncc(Cl)c(C)c1C(=O)N1C[C@@H]2C[C@@H](CNC(=O)c3ccccn3)[C@@H]2C1
|
COcnccCl)cC)c6C=O)NC[C@@H]C[C@@H]CNC=O)cccccn6)))))))))[C@@H]4C7
|
[C][O][C][=N][C][=C][Branch1][C][Cl][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=N][Ring1][=Branch1][C@@H1][Ring1][=C][C][Ring1][P]
|
c16ncc(Cl)c(C)c19.N14C[C@@H]2C[C@@H]%10[C@@H]2C1.c18ccccn1.C49=O.C58=O.CO6.C7%10.N57
|
CCC1(CNC(=O)[C@@H](NC(=O)Cc2ccsn2)C2(O)CCC2)CCC1
|
CCCCNC=O)[C@@H]NC=O)Ccccsn5))))))))CO)CCC4))))))))CCC4
|
[C][C][C][Branch2][Ring1][S][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][=C][S][N][=Ring1][Branch1][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][C][C][Ring2][Ring1][#Branch1]
|
C189CCC1.C3(=O)[C@@H]6%10.c17ccsn1.C1%10(O)CCC1.C4(=O)C7.CC8.C59.N35.N46
|
FC(F)(F)Cn1cc(CN=c2[nH]c3cc(Cl)ccc3o2)nn1
|
FCF)F)CnccCN=c[nH]cccCl)ccc6o9)))))))))))nn5
|
[F][C][Branch1][C][F][Branch1][C][F][C][N][C][=C][Branch2][Ring1][Ring1][C][N][=C][NH1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][Ring1][#Branch2][N][=N][Ring1][P]
|
C5N=c1[nH]c2cc(Cl)ccc2o1.n14cc5nn1.FC(F)(F)C4
|
COCCN1CCN(C(=NC[C@@H](C(=O)OC(C)(C)C)C(C)C)NC2CC2)CC1=O
|
COCCNCCNC=NC[C@@H]C=O)OCC)C)C))))CC)C)))))NCCC3)))))CC6=O
|
[C][O][C][C][N][C][C][N][Branch2][Ring2][C][C][=Branch2][Ring1][Branch2][=N][C][C@@H1][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][C][N][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][Branch2][=O]
|
N17CCN(C(=NC[C@@H](C3=O)C(C)C)N6)CC1=O.C5(C)(C)C.C4C7.C16CC1.CO4.O35
|
CC=CCONC(=O)CCC[C@H](CC)NC(=O)[C@H](CCC)NC(N)=O
|
CC=CCONC=O)CCC[C@H]CC))NC=O)[C@H]CCC)))NCN)=O
|
[C][C][=C][C][O][N][C][=Branch1][C][=O][C][C][C][C@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring2][C][C][C][N][C][Branch1][C][N][=O]
|
O3NC(=O)CCC[C@@H]4CC.C1(=O)[C@@H]5CCC.C=6C3.C2(N)=O.CC=6.N14.N25
|
COCC(=O)NC1CCN(N2CCC(OCc3ccccc3)CC2)CC1
|
COCC=O)NCCCNNCCCOCcccccc6))))))))CC6))))))CC6
|
[C][O][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Branch1][N][C][C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=C][C][C][Ring2][Ring1][Ring2]
|
C18CCN(N2CCC7CC2)CC1.c19ccccc1.C5C4=O.CO5.N48.O67.C69
|
CCCn1cc([C@H](C(=O)NC[C@H]2CCOC2)N(C)[C@H](C)c2ccccc2Cl)cn1
|
CCCncc[C@H]C=O)NC[C@H]CCOC5))))))))NC)[C@H]C)cccccc6Cl))))))))))cn5
|
[C][C][C][N][C][=C][Branch2][Ring2][C][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C][C@H1][C][C][O][C][Ring1][Branch1][N][Branch1][C][C][C@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=N][Ring2][Ring1][#Branch2]
|
c1%10ccccc1Cl.n17cc9cn1.[C@@H]49C3=O.[C@H]18CCOC1.CCC7.N46C.[C@H]6%10C.N35.C58
|
CCCOc1ccc(CNC(=O)Nc2ccc(C)c(C(C)=O)c2)c(OC(F)F)c1
|
CCCOccccCNC=O)NccccC)cCC)=O))c6))))))))))cOCF)F)))c6
|
[C][C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=C][Ring1][#Branch2][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring2][Ring1][=Branch2]
|
c16ccc%11c7c1.c19ccc(C)c%10c1.O7C(F)F.CCC5.C34=O.C%10(C)=O.O56.C8%11.N38.N49
|
COC(=O)c1cccc(C(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4NC(=O)C2=CCCC2)n1
|
COC=O)cccccC=O)NC[C@@H]C[C@H]C[C@H]5[C@H]8[C@H]5NC=O)C=CCCC5)))))))))))))))))n6
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][C][C@H1][Ring1][Branch1][C@H1][Ring1][Branch2][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Branch1][=N][Ring2][Ring1][=Branch2]
|
N16C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]38.c19cccc%10n1.C7(=O)C1=CCCC1.C59=O.C6%10=O.CO5.N78
|
CC[C@@H](C#N)C(=O)N1C[C@@H]2CC[C@]2(NC(=O)COCc2ccncc2)C1
|
CC[C@@H]C#N))C=O)NC[C@@H]CC[C@]4NC=O)COCcccncc6)))))))))))C7
|
[C][C][C@@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][P][N][C][=Branch1][C][=O][C][O][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring1]
|
N13C[C@@H]2CC[C@]27C1.CC[C@@H](C#N)C3=O.c18ccncc1.C4(=O)C5.N47.O56.C68
|
COCc1ccc(NC(=O)C2(C)CC(NC(=O)c3cnnc(C)c3C)C2)cc1
|
COCccccNC=O)CC)CCNC=O)ccnncC)c6C)))))))))C4))))))cc6
|
[C][O][C][C][=C][C][=C][Branch2][Ring2][Ring1][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][N][=N][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][Ring1][S][C][=C][Ring2][Ring1][=Branch2]
|
c1%10cnnc(C)c1C.c1%11ccc7cc1.C19(C)CC8C1.C49=O.C5%10=O.CO6.C6%11.N47.N58
|
C=CCC(=O)N1CCO[C@]2(CCN(c3ccc(C(F)(F)F)cn3)C2)C1
|
C=CCC=O)NCCO[C@]CCNccccCF)F)F))cn6))))))C5))))C6
|
[C][=C][C][C][=Branch1][C][=O][N][C][C][O][C@][Branch2][Ring1][N][C][C][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=N][Ring1][#Branch2][C][Ring1][#C][C][Ring2][Ring1][Ring2]
|
N14CCO[C@]2(CCN5C2)C1.c15ccc6cn1.C=CCC4=O.C6(F)(F)F
|
CCO[C@H](CCNc1[nH]c(=N[C@H](C)c2nc[nH]n2)nc2scnc12)C1CCCC1
|
CCO[C@H]CCNc[nH]c=N[C@H]C)cnc[nH]n5)))))))ncscnc95))))))))))))CCCCC5
|
[C][C][O][C@H1][Branch2][Ring1][#C][C][C][N][C][NH1][C][=Branch1][=N][=N][C@H1][Branch1][C][C][C][N][=C][NH1][N][=Ring1][Branch1][N][=C][S][C][=N][C][=Ring1][P][Ring1][Branch1][C][C][C][C][C][Ring1][Branch1]
|
c16[nH]c(=N[C@@H]7C)nc2scnc12.[C@H]48CC5.c17nc[nH]n1.C18CCCC1.CC3.O34.N56
|
CCC[C@H](O)[C@H](CO)NC(=O)C(C)(C)[C@@H]1CCN(C(=O)[C@H](O)CN2CCCC2)C1
|
CCC[C@H]O)[C@H]CO))NC=O)CC)C)[C@@H]CCNC=O)[C@H]O)CNCCCC5))))))))C5
|
[C][C][C][C@H1][Branch1][C][O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][N][C][C][C][C][Ring1][Branch1][C][Ring1][#C]
|
CCC[C@H](O)[C@@H]5CO.C3(=O)C7(C)C.[C@@H]17CCN4C1.C4(=O)[C@H](O)C6.N16CCCC1.N35
|
CCO[C@@H](C)c1cn(CC2CCN(C(=O)CCc3cc(Cl)cs3)CC2)nn1
|
CCO[C@@H]C)ccnCCCCNC=O)CCcccCl)cs5))))))))CC6)))))))nn5
|
[C][C][O][C@@H1][Branch1][C][C][C][=C][N][Branch2][Ring1][N][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][=C][C][Branch1][C][Cl][=C][S][Ring1][=Branch1][C][C][Ring1][S][N][=N][Ring2][Ring1][=Branch1]
|
C1%10CCN4CC1.c18cn7nn1.c19cc(Cl)cs1.C4(=O)CC9.[C@@H]68C.CC5.O56.C7%10
|
NC(=O)c1cc(C(=O)N[C@@H]2C=C[C@H](CNC(=O)C=Cc3ccccc3)C2)n[nH]1
|
NC=O)cccC=O)N[C@@H]C=C[C@H]CNC=O)C=Ccccccc6)))))))))))C5)))))))n[nH]5
|
[N][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][=C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P][=N][NH1][Ring2][Ring1][=Branch2]
|
C=%10c1ccccc1.c18cc9n[nH]1.[C@@H]17C=C[C@H]%11C1.C5(=O)C=%10.NC8=O.C49=O.N47.C6%11.N56
|
CC(F)(F)CCC(=O)N1CC[C@H]2CCN(C(=O)c3nnsc3N)C[C@H]21
|
CCF)F)CCC=O)NCC[C@H]CCNC=O)cnnsc5N)))))))C[C@H]69
|
[C][C][Branch1][C][F][Branch1][C][F][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][=N][S][C][=Ring1][Branch1][N][C][C@H1][Ring1][=C][Ring1][P]
|
N14CC[C@H]2CCN5C[C@H]21.CC(F)(F)CCC4=O.c16nnsc1N.C56=O
|
C[C@H](NC(=O)C1C[C@@H]2C[C@H]2C1)C1CCN(C(=O)[C@H]2[C@H]3CC[C@@]2(C)C3(C)C)CC1
|
C[C@H]NC=O)CC[C@@H]C[C@H]3C6))))))))CCCNC=O)[C@H][C@H]CC[C@@]5C)C5C)C))))))))CC6
|
[C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][Ring1][=Branch1][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C@H1][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][Ring1][=Branch1][Branch1][C][C][C][C][C][Ring1][P]
|
[C@H]18[C@H]2CC[C@@]1(C)C2(C)C.C19CCN5CC1.C17C[C@@H]2C[C@H]2C1.C[C@H]69.C47=O.C58=O.N46
|
O=C(NCCC[C@H](O)C(=O)N[C@@H]1CC2(CCC2)[C@@H]1O)c1cc(C2CC2)[nH]n1
|
O=CNCCC[C@H]O)C=O)N[C@@H]CCCCC4)))[C@@H]4O))))))))))))cccCCC3)))[nH]n5
|
[O][=C][Branch2][Ring1][N][N][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C@@H1][Ring1][#Branch1][O][C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][NH1][N][=Ring1][Branch2]
|
C5CC[C@H](O)C4=O.[C@@H]16CC2(CCC2)[C@@H]1O.c17cc8[nH]n1.O=C37.C18CC1.N35.N46
|
C=C1CC(C)(C(=O)N2C[C@H]3CC[C@@H](C2)N3C(=O)[C@@]2(F)CCCN(C)C2)C1
|
C=CCCC)C=O)NC[C@H]CC[C@@H]C7)N5C=O)[C@@]F)CCCNC)C6)))))))))))))))C4
|
[C][=C][C][C][Branch1][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][C][N][Branch1][C][C][C][Ring1][Branch2][C][Ring2][Ring1][=Branch2]
|
N14C[C@H]2CC[C@@H](C1)N25.[C@]17(F)CCCN(C)C1.C=C1CC6(C)C1.C46=O.C57=O
|
CC[C@H](C)n1nccc1C(=O)N1C[C@H]2CN(C(=O)c3cnn(C)c3Cl)C[C@@H](C1)O2
|
CC[C@H]C)nnccc5C=O)NC[C@H]CNC=O)ccnnC)c5Cl)))))))C[C@@H]C8)O6
|
[C][C][C@H1][Branch1][C][C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][Cl][C][C@@H1][Branch1][Ring2][C][Ring1][P][O][Ring1][S]
|
N14C[C@@H]2CN5C[C@H](C1)O2.c17cnn(C)c1Cl.n18nccc16.CC[C@@H]8C.C46=O.C57=O
|
Cc1nccc(C(=O)NC[C@@H](F)C2CCN(C(=O)c3ncoc3C)CC2)c1C
|
CcncccC=O)NC[C@@H]F)CCCNC=O)cncoc5C)))))))CC6))))))))))c6C
|
[C][C][=N][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][F][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][=C][O][C][=Ring1][Branch1][C][C][C][Ring1][=C][=C][Ring2][Ring1][#Branch2][C]
|
Cc1nccc8c1C.C19CCN5CC1.c17ncoc1C.C6[C@H]9F.C48=O.C57=O.N46
|
Cn1ncc2c1CC(C)(C)CN(N1CCN(C3CCOCC3)CC1)C2
|
Cnnccc5CCC)C)CNNCCNCCCOCC6))))))CC6))))))C7
|
[C][N][N][=C][C][=C][Ring1][Branch1][C][C][Branch1][C][C][Branch1][C][C][C][N][Branch2][Ring1][Ring1][N][C][C][N][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][C][C][Ring1][N][C][Ring2][Ring1][Branch1]
|
Cn1ncc2c1CC(C)(C)CN(N1CCN4CC1)C2.C14CCOCC1
|
CC(C)C1(CNC(=O)[C@@H](C)CN(C)C(=O)[C@H](C)n2cncn2)CC1
|
CCC)CCNC=O)[C@@H]C)CNC)C=O)[C@H]C)ncncn5)))))))))))))CC3
|
[C][C][Branch1][C][C][C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=N][C][=N][Ring1][Branch1][C][C][Ring2][Ring1][Branch1]
|
C3(=O)[C@@H](C)C6.C4(=O)[C@@H]7C.n17cncn1.C189CC1.CC8C.N46C.C59.N35
|
C/C(=C\C(=O)NCC1CN(C(=O)/C=C/c2ccccc2)C1)c1ccc(F)cc1
|
C/C=C\C=O)NCCCNC=O)/C=C/cccccc6)))))))))C4))))))))ccccF)cc6
|
[C][/C][=Branch2][Ring1][=C][=C][\C][=Branch1][C][=O][N][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
CC=6c1ccc(F)cc1.C=7c1ccccc1.C18CN4C1.C=6C3=O.C4(=O)C=7.N35.C58
|
Cn1cnc(C=CC(=O)N2C[C@H](O)C[C@@H](NC(=O)c3ccc4ncsc4c3)C2)c1
|
CncncC=CC=O)NC[C@H]O)C[C@@H]NC=O)ccccncsc5c9)))))))))))C6)))))))))c5
|
[C][N][C][=N][C][Branch2][Ring2][Branch2][C][=C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][N]
|
c18ccc2ncsc2c1.N15C[C@H]7C[C@@H](O)C1.Cn1cnc(C=9)c1.C=9C5=O.C68=O.N67
|
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