SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
CCOCCOCC(=O)N1CC[C@](CO)(C(=O)N2C[C@@H](C)CCC[C@H]2C)C1
|
CCOCCOCC=O)NCC[C@]CO))C=O)NC[C@@H]C)CCC[C@H]7C)))))))))C5
|
[C][C][O][C][C][O][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][Ring1][C][O][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C][C][C@H1][Ring1][Branch2][C][C][Ring2][Ring1][C]
|
N14C[C@@H](C)CCC[C@H]1C.N13CC[C@@]9%10C1.C8C3=O.C6C7.C49=O.CC5.O56.O78.C%10O
|
CC1(CNC(=NC[C@@H]2CCN2C2CCCCC2)NC[C@@H]2CCCO2)CCOCC1
|
CCCNC=NC[C@@H]CCN4CCCCCC6))))))))))))NC[C@@H]CCCO5))))))))))CCOCC6
|
[C][C][Branch2][Ring1][#C][C][N][C][=Branch1][P][=N][C][C@@H1][C][C][N][Ring1][Ring2][C][C][C][C][C][C][Ring1][=Branch1][N][C][C@@H1][C][C][C][O][Ring1][Branch1][C][C][O][C][C][Ring2][Ring1][N]
|
CC18CCOCC1.N3C(=NC6)N4.C15CCCCC1.[C@@H]16CCN15.[C@@H]17CCCO1.C38.C47
|
N#C[C@@H]1C[C@@H](F)CN1[C@@H](C(=O)NC1CCC1)c1cc([N+](=O)[O-])sn1
|
N#C[C@@H]C[C@@H]F)CN5[C@@H]C=O)NCCCC4))))))ccc[N+]=O)[O-]))sn5
|
[N][#C][C@@H1][C][C@@H1][Branch1][C][F][C][N][Ring1][=Branch1][C@@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring2][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][S][N][=Ring1][Branch2]
|
N#C[C@@H]1C[C@@H](F)CN13.c15cc([N+](=O)[O-])sn1.[C@@H]35C2=O.C14CCC1.N24
|
C[C@@H](NC(N)=O)C(=O)N[C@H]1C[C@@H](C(=O)N[C@H]2CCCC(C)(C)C2)C1
|
C[C@@H]NCN)=O)))C=O)N[C@H]C[C@@H]C=O)N[C@H]CCCCC)C)C6))))))))C4
|
[C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@H1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2][C][Ring1][#C]
|
[C@H]18CCCC(C)(C)C1.C[C@@H]6C4=O.[C@H]17C[C@@H]9C1.C3(N)=O.C59=O.N36.N47.N58
|
CCOCC(=O)N(C)CC1CCN(C(=O)C(F)(F)CF)CC1
|
CCOCC=O)NC)CCCCNC=O)CF)F)CF))))CC6
|
[C][C][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][F][C][C][Ring1][=N]
|
C17CCN3CC1.C3(=O)C(F)(F)CF.C5C2=O.N26C.CC4.O45.C67
|
CN(CCCOCCNC(=O)C1=C[C@H]2CCC[C@@H]12)C(=O)c1ccc(Cl)cc1O
|
CNCCCOCCNC=O)C=C[C@H]CCC[C@@H]75)))))))))))))))C=O)ccccCl)cc6O
|
[C][N][Branch2][Ring1][#Branch1][C][C][C][O][C][C][N][C][=Branch1][C][=O][C][=C][C@H1][C][C][C][C@@H1][Ring1][#Branch1][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O]
|
C3(=O)C1=C[C@H]2CCC[C@@H]12.c19ccc(Cl)cc1O.C7CC5.CN47.C6C8.C49=O.O56.N38
|
COC(=O)[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1C1(NC(=O)CCC2CC(F)(F)C2)CC1
|
COC=O)[C@@H]C[C@@H]3C=O)NCCCC[C@H]6CNC=O)CCCCCF)F)C4))))))))CC3
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][C][Ring1][=C]
|
N14CCCC[C@H]1%10.C19CC(F)(F)C1.C5(=O)CC9.[C@@H]17C[C@@H]18.C16%10CC1.C37=O.C48=O.CO3.N56
|
C[C@@]1(C(=O)N[C@@H]2C[C@H](C(=O)NC3CC(CO)(CO)C3)C[C@H]2O)CNC(=O)N1
|
C[C@@]C=O)N[C@@H]C[C@H]C=O)NCCCCO))CO))C4))))))C[C@H]5O))))))))CNC=O)N5
|
[C][C@@][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][O][Branch1][Ring1][C][O][C][Ring1][Branch2][C][C@H1][Ring1][S][O][C][N][C][=Branch1][C][=O][N][Ring2][Ring1][#Branch2]
|
C[C@@]18CNC(=O)N1.[C@@H]16C[C@H]9C[C@H]1O.C17CC%10%11C1.C48=O.C59=O.N46.N57.C%10O.C%11O
|
N#C[C@H]1CC[C@@H](C(=O)N[C@H]2C[C@@H](NC(=O)c3cccnc3S)C2)C1
|
N#C[C@H]CC[C@@H]C=O)N[C@H]C[C@@H]NC=O)ccccnc6S)))))))))C4))))))C5
|
[N][#C][C@H1][C][C][C@@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][S][C][Ring1][=C][C][Ring2][Ring1][=Branch1]
|
N#C[C@H]1CC[C@@H]8C1.c19cccnc1S.[C@H]16C[C@@H]7C1.C48=O.C59=O.N46.N57
|
Cc1nc(S(=O)(=O)N2CCN(C(=O)NCc3c(F)cccc3I)CC2)cn1C
|
CcncS=O)=O)NCCNC=O)NCccF)cccc6I))))))))))CC6)))))))cn5C
|
[C][C][=N][C][Branch2][Ring2][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][I][C][C][Ring2][Ring1][C][=C][N][Ring2][Ring1][#Branch2][C]
|
Cc1nc(S7(=O)=O)cn1C.c18c(F)cccc1I.N17CCN4CC1.C45=O.N56.C68
|
Cc1cc(C(=O)NC[C@@H]2CCCN(C(=O)[C@H](C)C(C)(C)O)CC2)ccn1
|
CcccC=O)NC[C@@H]CCCNC=O)[C@H]C)CC)C)O))))CC7))))))))))ccn6
|
[C][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][C][Ring1][#C][=C][C][=N][Ring2][Ring1][=Branch2]
|
[C@@H]17CCCN4CC1.C4(=O)[C@H](C)C(C)(C)O.Cc1cc6ccn1.C36=O.N35.C57
|
CCC(C)=C(C)C(=O)N1C[C@@H](COC)C[C@H]1CNC(=O)C(=O)c1cnn(CC)c1
|
CCCC)=CC)C=O)NC[C@@H]COC)))C[C@H]5CNC=O)C=O)ccnnCC))c5
|
[C][C][C][Branch1][C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring2][C][O][C][C][C@H1][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][C][=N][N][Branch1][Ring1][C][C][C][=Ring1][#Branch1]
|
N12C[C@@H]%10C[C@H]19.c16cnn8c1.C=7(C)C2=O.C3(=O)C6=O.CCC=7C.C4%10.O4C.C59.N35.C8C
|
O=C(NC[C@@H]1CCC[C@H](C(F)(F)F)O1)c1cc(-c2ccccc2F)cnc1O
|
O=CNC[C@@H]CCC[C@H]CF)F)F))O6))))))))ccc-cccccc6F)))))))cnc6O
|
[O][=C][Branch2][Ring1][Branch1][N][C][C@@H1][C][C][C][C@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][O][Ring1][#Branch2][C][=C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=C][N][=C][Ring1][=N][O]
|
c15cc8cnc1O.[C@@H]16CCC[C@H]7O1.c18ccccc1F.C7(F)(F)F.O=C35.N34.C46
|
COc1ncc(C(=O)Nc2ccc(Cl)c(F)c2)cc1-c1ccn2cnnc2c1
|
COcnccC=O)NccccCl)cF)c6))))))))cc6-cccncnnc5c9
|
[C][O][C][=N][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][F][=C][Ring1][Branch2][C][=C][Ring1][P][C][C][=C][N][C][=N][N][=C][Ring1][Branch1][C][=Ring1][=Branch2]
|
c17ccn2cnnc2c1.c14ncc6cc17.c15ccc(Cl)c(F)c1.C36=O.CO4.N35
|
C[C@H](CC(=O)N[C@H]1CC[C@@]2(CCN(C(=O)c3cc(O)nc(O)n3)C2)C1)CN(C)C
|
C[C@H]CC=O)N[C@H]CC[C@@]CCNC=O)cccO)ncO)n6)))))))C5))))C5))))))))CNC)C
|
[C][C@H1][Branch2][Ring2][=N][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@][Branch2][Ring1][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][C][O][=N][Ring1][Branch2][C][Ring1][#C][C][Ring2][Ring1][Ring1][C][N][Branch1][C][C][C]
|
[C@H]17CC[C@@]2(CCN5C2)C1.c18cc(O)nc(O)n1.C[C@@H](C6)CC4=O.C58=O.N6(C)C.N47
|
COCCc1nc(=NC2(CNC(=O)Cc3ccc4ncsc4c3)CC2)s[nH]1
|
COCCcnc=NCCNC=O)Cccccncsc5c9)))))))))))))CC3))))s[nH]5
|
[C][O][C][C][C][=N][C][=Branch2][Ring1][=C][=N][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C][Ring1][P][S][NH1][Ring2][Ring1][#Branch1]
|
c18nc(=NC29CC2)s[nH]1.c1%10ccc2ncsc2c1.C5(=O)C%10.C6C8.CO6.C79.N57
|
C=C(C)CCCC(=O)N(C)[C@H]1CCCN(c2ncn(C)c(=O)c2Br)CC1
|
C=CC)CCCC=O)NC)[C@H]CCCNcncnC)c=O)c6Br)))))))CC7
|
[C][=C][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][C][N][Branch1][S][C][N][=C][N][Branch1][C][C][C][=Branch1][C][=O][C][=Ring1][Branch2][Br][C][C][Ring1][S]
|
c14ncn(C)c(=O)c1Br.C=C(C)CCCC3=O.[C@H]15CCCN4CC1.N35C
|
Cc1csc(CC(=O)N(C)[C@H]2C[C@@H](NC(=O)c3cnc(C(C)(C)C)o3)C2)c1
|
CccscCC=O)NC)[C@H]C[C@@H]NC=O)ccncCC)C)C))o5)))))))C4)))))))c5
|
[C][C][=C][S][C][Branch2][Ring2][=Branch2][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][O][Ring1][=Branch2][C][Ring1][S][=C][Ring2][Ring1][#Branch2]
|
Cc1csc9c1.c18cnc%10o1.[C@H]16C[C@@H]7C1.C9C4=O.C%10(C)(C)C.N46C.C58=O.N57
|
CCCC[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC3(CCC3)CO2)C[C@H]1C
|
CCCC[C@H]C)C=O)NC[C@@H]CCNC=O)[C@@H]CCCCC4)))CO5))))))C[C@H]6C
|
[C][C][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][O][Ring1][Branch2][C][C@H1][Ring1][S][C]
|
CCCC[C@H](C)C4=O.[C@@H]18CCN5C[C@H]1C.[C@@H]17CC2(CCC2)CO1.C57=O.N46.C68
|
O=C(CCF)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)cc(=O)o2)CC1
|
O=CCCF)))NCCC[C@@H]CCCCN6C=O)cccO)cc=O)o6)))))))))))))CC6
|
[O][=C][Branch1][Ring2][C][C][F][N][C][C][C][Branch2][Ring1][O][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=Branch1][C][=O][O][Ring1][Branch2][C][C][Ring2][Ring1][=Branch1]
|
c15cc(O)cc(=O)o1.N13CCC6CC1.[C@@H]16CCCCN14.O=C3CCF.C45=O
|
COCCC1(C(=O)N[C@@H]2C=C[C@H](CC(=O)NC[C@@H]3CCCN3C)C2)CC1
|
COCCCC=O)N[C@@H]C=C[C@H]CC=O)NC[C@@H]CCCN5C))))))))))C5)))))))CC3
|
[C][O][C][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][C][=C][C@H1][Branch1][S][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Ring1][Branch1][C][C][Ring1][S][C][C][Ring2][Ring1][=Branch1]
|
[C@@H]18C=C[C@H]%12C1.[C@@H]1%10CCCN1C.C19%11CC1.C%12C5=O.C6C%11.C49=O.CO6.N48.N57.C7%10
|
CCC1(NC(=O)C[C@H]2CCc3ccccc32)CCN(C(=O)[C@@H](C)OC)CC1
|
CCCNC=O)C[C@H]CCcccccc69))))))))))))CCNC=O)[C@@H]C)OC))))CC6
|
[C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][C][N][Branch1][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][C][Ring2][Ring1][=Branch2]
|
C4(=O)C[C@H]1CCc2ccccc21.C178CCN5CC1.C5(=O)[C@H]6C.CC8.N47.O6C
|
O=C(C[C@@H]1CCNC1=O)NCC1(NC(=O)CN2CSCC2=O)CCCCC1
|
O=CC[C@@H]CCNC5=O)))))))NCCNC=O)CNCSCC5=O)))))))))CCCCC6
|
[O][=C][Branch1][#Branch2][C][C@@H1][C][C][N][C][Ring1][Branch1][=O][N][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][N][C][S][C][C][Ring1][Branch1][=O][C][C][C][C][C][Ring1][S]
|
C169CCCCC1.[C@@H]18CCNC1=O.N17CSCC1=O.O=C3C8.C4(=O)C7.N35.C59.N46
|
C=CCCC1(C(=O)NCc2cnn(C)c2C)CN(C(=O)c2oncc2CC)C1
|
C=CCCCC=O)NCccnnC)c5C)))))))))CNC=O)concc5CC))))))))C4
|
[C][=C][C][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][O][N][=C][C][=Ring1][Branch1][C][C][C][Ring2][Ring1][Branch2]
|
c19cnn(C)c1C.C178CN4C1.c16oncc1%10.C=CCC8.C37=O.C46=O.N35.C59.C%10C
|
COC[C@@H]1CCCCN(C(=O)CC[C@@H]2CCCCN(C(=O)CC(C)(C)OC)C2)C1
|
COC[C@@H]CCCCNC=O)CC[C@@H]CCCCNC=O)CCC)C)OC)))))C7))))))))))C7
|
[C][O][C][C@@H1][C][C][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][O][C][C][Ring1][#C][C][Ring2][Ring1][#Branch2]
|
[C@@H]17CCCCN3C1.[C@@H]18CCCCN4C1.C4(=O)CC6(C)C.C3(=O)CC8.CO5.C57.O6C
|
COc1nc(C)c(Br)cc1C(=O)N(C)CCNC(=O)c1ccc(C(C)=O)cn1
|
COcncC)cBr)cc6C=O)NC)CCNC=O)ccccCC)=O))cn6
|
[C][O][C][=N][C][Branch1][C][C][=C][Branch1][C][Br][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][C][=N][Ring1][=Branch2]
|
c14nc(C)c(Br)cc18.c17ccc9cn1.C28=O.N25C.C5C6.C37=O.C9(C)=O.CO4.N36
|
Cc1cc(N(C)[C@H](C)CCNC(=O)[C@@]23CCC[C@@](C)(C2)OC3)nc(C)n1
|
CcccNC)[C@H]C)CCNC=O)[C@@]CCC[C@@]C)C6)OC7)))))))))))))ncC)n6
|
[C][C][=C][C][Branch2][Ring1][P][N][Branch1][C][C][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C@@][C][C][C][C@@][Branch1][C][C][Branch1][Ring2][C][Ring1][#Branch1][O][C][Ring1][=Branch2][=N][C][Branch1][C][C][=N][Ring2][Ring1][=Branch2]
|
[C@@]128CCC[C@@](C)(C1)OC2.Cc1cc7nc(C)n1.[C@@H]5(C)CC6.N57C.C48=O.N46
|
CCOc1c(OC)cc(CNc2ccnc3c2cnn3C)cc1OC
|
CCOccOC))ccCNcccncc6cnn5C))))))))))))cc6OC
|
[C][C][O][C][=C][Branch1][Ring1][O][C][C][=C][Branch1][P][C][N][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C][C][=C][Ring2][Ring1][Ring2][O][C]
|
c19ccnc2c1cnn2C.c15c6cc%10cc17.CC4.O45.O6C.C8%10.N89.O7C
|
CN1CC=C(CC(=O)N[C@H]2C[C@@H](CNC(=O)C[C@H]3COC(=O)N3)C2)CC1
|
CNCC=CCC=O)N[C@H]C[C@@H]CNC=O)C[C@H]COC=O)N5)))))))))C4)))))))CC6
|
[C][N][C][C][=C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][Ring1][#C][C][C][Ring2][Ring1][=Branch2]
|
CN1CC=C(CC4=O)CC1.[C@H]18COC(=O)N1.[C@H]17C[C@@H]9C1.C5(=O)C8.N47.C69.N56
|
CC(C)OCCC(=O)N1CCC(CCNC(=O)[C@H]2[C@H](C)[C@H](C)O[C@H]2C)CC1
|
CCC)OCCC=O)NCCCCCNC=O)[C@H][C@H]C)[C@H]C)O[C@H]5C))))))))))CC6
|
[C][C][Branch1][C][C][O][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C@H1][Branch1][C][C][C@H1][Branch1][C][C][O][C@H1][Ring1][#Branch1][C][C][C][Ring2][Ring1][Ring1]
|
[C@H]18[C@H](C)[C@H](C)O[C@H]1C.N13CCC9CC1.C6CC3=O.CC5C.C9C7.C48=O.O56.N47
|
COCc1ccoc1C(=O)N[C@H]1C[C@@H](O)CN(C(=O)c2cc(F)c[nH]2)C1
|
COCcccoc5C=O)N[C@H]C[C@@H]O)CNC=O)cccF)c[nH]5))))))C6
|
[C][O][C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][C][O][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][NH1][Ring1][=Branch1][C][Ring1][#C]
|
[C@H]16C[C@@H](O)CN4C1.c19ccoc17.c18cc(F)c[nH]1.C37=O.C48=O.CO5.C59.N36
|
Cc1ccc(CCC(=O)N2CC[C@@H]2CNC(=O)C23CC(C[C@@H](C)O2)C3)s1
|
CccccCCC=O)NCC[C@@H]4CNC=O)CCCC[C@@H]C)O6)))C4))))))))))))))s5
|
[C][C][=C][C][=C][Branch2][Ring2][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][Branch1][=Branch2][C][C@@H1][Branch1][C][C][O][Ring1][#Branch1][C][Ring1][Branch2][S][Ring2][Ring1][=Branch2]
|
C127CC(C[C@@H](C)O1)C2.Cc1ccc9s1.C9CC4=O.N14CC[C@@H]18.C57=O.C68.N56
|
CCC1=NO[C@H](CC(=O)N(C)CCN(C)C(=O)[C@H]2CC(C3CC3)=NO2)C1
|
CCC=NO[C@H]CC=O)NC)CCNC)C=O)[C@H]CCCCC3)))=NO5))))))))))))C5
|
[C][C][C][=N][O][C@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2][C][Ring2][Ring1][Branch2]
|
[C@H]18CC(C2CC2)=NO1.CCC1=NO[C@H]9C1.C9C4=O.N46C.C6C7.N57C.C58=O
|
c1ccc(-n2cnc(-c3ccc4ncoc4c3)n2)nc1
|
cccc-ncnc-ccccncoc5c9)))))))))n5)))))nc6
|
[C][=C][C][=C][Branch2][Ring1][#Branch1][N][C][=N][C][Branch1][=C][C][=C][C][=C][N][=C][O][C][Ring1][Branch1][=C][Ring1][=Branch2][=N][Ring1][=C][N][=C][Ring2][Ring1][Ring2]
|
c16ccc2ncoc2c1.c1ccc5nc1.n15cnc6n1
|
CC[C@@H](CC(=O)NCCNC(=O)[C@@H]1[C@@H](C)OCCN1C(=O)OC(C)(C)C)C1CC1
|
CC[C@@H]CC=O)NCCNC=O)[C@@H][C@@H]C)OCCN6C=O)OCC)C)C)))))))))))))))))CCC3
|
[C][C][C@@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C@@H1][C@@H1][Branch1][C][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Ring1][Ring1]
|
[C@@H]19[C@@H](C)OCCN15.CC[C@H]%10CC3=O.C6(C)(C)C.C7C8.C49=O.C25=O.C1%10CC1.N37.N48.O26
|
C=C(Br)CN(C)C(=O)CCCn1cc(CCN2CC(C)(C)OC(C)(C)C2)nn1
|
C=CBr)CNC)C=O)CCCnccCCNCCC)C)OCC)C)C6))))))))nn5
|
[C][=C][Branch1][C][Br][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][N][C][=C][Branch2][Ring1][#Branch1][C][C][N][C][C][Branch1][C][C][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2][N][=N][Ring1][P]
|
N15CC(C)(C)OC(C)(C)C1.C3(=O)CCC6.n16cc7nn1.C=C(Br)C4.N34C.C7C5
|
C[C@@H]1CC=C(C(=O)N[C@@H](C)[C@]2(O)CCN(C(=O)c3cnc4n3CCC4)C2)CC1
|
C[C@@H]CC=CC=O)N[C@@H]C)[C@]O)CCNC=O)ccncn5CCC5)))))))))C5))))))))CC6
|
[C][C@@H1][C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@][Branch1][C][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][C][C][Ring1][Branch1][C][Ring1][S][C][C][Ring2][Ring1][O]
|
C[C@@H]1CC=C(C5=O)CC1.c18cnc2n1CCC2.[C@@]19(O)CCN6C1.[C@@H]79C.C68=O.N57
|
COCCCC(=O)N1CCC(CCNC(=O)c2ccc(C(C)=O)o2)CC1
|
COCCCC=O)NCCCCCNC=O)ccccCC)=O))o5)))))))))CC6
|
[C][O][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][O][Ring1][Branch2][C][C][Ring2][Ring1][Ring1]
|
N13CCC9CC1.C5CCC3=O.c17ccc8o1.C9C6.C47=O.C8(C)=O.CO5.N46
|
CC[C@H](CCCC(=O)NOCCCOC)NC(=O)Cc1cnoc1
|
CC[C@H]CCCC=O)NOCCCOC)))))))))))NC=O)Cccnoc5
|
[C][C][C@H1][Branch1][#C][C][C][C][C][=Branch1][C][=O][N][O][C][C][C][O][C][N][C][=Branch1][C][=O][C][C][C][=N][O][C][=Ring1][Branch1]
|
CC[C@@H]5CCCC(=O)NO3.c16cnoc1.C3CC4.C2(=O)C6.O4C.N25
|
CC1(C)CCC[C@H](N=c2nc(N3CC[C@@H](n4cncn4)C3)c3c([nH]2)CCCC3)C1
|
CCC)CCC[C@H]N=cncNCC[C@@H]ncncn5)))))C5)))))cc[nH]6)CCCC6))))))))))C6
|
[C][C][Branch1][C][C][C][C][C][C@H1][Branch2][Ring2][Ring2][N][=C][N][=C][Branch1][P][N][C][C][C@@H1][Branch1][Branch2][N][C][=N][C][=N][Ring1][Branch1][C][Ring1][#Branch2][C][=C][Branch1][Ring2][NH1][Ring1][S][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][N]
|
CC1(C)CCC[C@H](N=c2nc5c3c([nH]2)CCCC3)C1.N15CC[C@@H]6C1.n16cncn1
|
C[C@@H](NC(=O)c1ccncn1)[C@@]1(O)CCN(C(=O)C#CC(C)(C)O)C1
|
C[C@@H]NC=O)cccncn6))))))))[C@@]O)CCNC=O)C#CCC)C)O)))))C5
|
[C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=N][Ring1][=Branch1][C@@][Branch1][C][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][=C]
|
C3(=O)C#CC(C)(C)O.[C@]16(O)CCN3C1.c15ccncn1.C[C@@H]46.C25=O.N24
|
Cc1oncc1C(=O)N(Cc1cn([C@@H]2CCC[C@@H](C(=O)O)C2)nn1)C1CC1
|
Cconcc5C=O)NCccn[C@@H]CCC[C@@H]C=O)O))C6))))))nn5))))))CCC3
|
[C][C][O][N][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch2][C][C][=C][N][Branch1][S][C@@H1][C][C][C][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Ring1][=Branch2][N][=N][Ring1][=C][C][C][C][Ring1][Ring1]
|
[C@@H]19CCC[C@@H]6C1.Cc1oncc17.c18cn9nn1.C37=O.N345.C6(=O)O.C15CC1.C48
|
C#Cc1cn(C)nc1C(=O)NC1([C@H]2CCCN(C(=O)[C@H](C)OC(C)(C)C)C2)CC1
|
C#CccnC)nc5C=O)NC[C@H]CCCNC=O)[C@H]C)OCC)C)C)))))C6))))))CC3
|
[C][#C][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][=N][C@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#C][C][C][Ring2][Ring1][C]
|
C17([C@H]2CCCN4C2)CC1.C#Cc1cn(C)nc18.C4(=O)[C@@H]5C.C6(C)(C)C.C38=O.N37.O56
|
Cn1cc(Br)c(CN2C[C@@H]3[C@@H](CNC(=O)c4ccc(-n5cnnn5)cc4)[C@@H]3C2)n1
|
CnccBr)cCNC[C@@H][C@@H]CNC=O)cccc-ncnnn5)))))cc6)))))))))[C@@H]3C6)))))))n5
|
[C][N][C][=C][Branch1][C][Br][C][Branch2][Ring2][Branch2][C][N][C][C@@H1][C@@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][=C][Ring1][O][C@@H1][Ring2][Ring1][C][C][Ring2][Ring1][Branch1][=N][Ring2][Ring1][N]
|
Cn1cc(Br)c%10n1.N17C[C@@H]2[C@@H]%11[C@@H]2C1.c19ccc%12cc1.n1%12cnnn1.C69=O.C7%10.C8%11.N68
|
O=C(NCC1CCS(=O)(=O)CC1)[C@H]1C[C@H](O)CCN1
|
O=CNCCCCS=O)=O)CC6))))))))[C@H]C[C@H]O)CCN6
|
[O][=C][Branch1][P][N][C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][Branch2][C@H1][C][C@H1][Branch1][C][O][C][C][N][Ring1][#Branch1]
|
C15CCS(=O)(=O)CC1.[C@H]14C[C@H](O)CCN1.O=C24.N23.C35
|
C=CCC1(C(=O)NCCN(CC)C(=O)c2ccc(=O)n(C[C@@H](C)O)c2)CCCC1
|
C=CCCC=O)NCCNCC))C=O)cccc=O)nC[C@@H]C)O)))c6))))))))))))CCCC5
|
[C][=C][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C@@H1][Branch1][C][C][O][C][=Ring1][O][C][C][C][C][Ring2][Ring1][#Branch2]
|
c19ccc(=O)n%10c1.C18%11CCCC1.C%10[C@@H](C)O.C=CC%11.C38=O.C5C6.N467.C49=O.N35.C7C
|
C/C(=C\C(=O)N1CC(C[C@H](C)NC(=O)[C@@H](c2cnc(C)s2)C(C)C)C1)C(F)(F)F
|
C/C=C\C=O)NCCC[C@H]C)NC=O)[C@@H]ccncC)s5)))))CC)C)))))))C4))))))CF)F)F
|
[C][/C][=Branch2][Ring2][N][=C][\C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=N][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][O][C][=C][N][=C][Branch1][C][C][S][Ring1][=Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
|
C4(=O)[C@@H]7C(C)C.CC=6C(F)(F)F.c17cnc(C)s1.N13CC8C1.C=6C3=O.C8[C@@H]5C.N45
|
CC(C)CNC(=O)[C@@H](c1ccc2c(c1)OCCO2)N(C)CCNS(C)(=O)=O
|
CCC)CNC=O)[C@@H]cccccc6)OCCO6)))))))))NC)CCNSC)=O)=O
|
[C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][P][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][N][Branch1][C][C][C][C][N][S][Branch1][C][C][=Branch1][C][=O][=O]
|
c19ccc2c(c1)OCCO2.C3(=O)[C@H]59.CC(C)C4.S8(C)(=O)=O.N56C.C6C7.N34.N78
|
CC(C)[C@H]1OCC[C@H]1c1nc(CC(C)(C)C)nn1-c1ccn(C2CCOCC2)n1
|
CCC)[C@H]OCC[C@H]5cncCCC)C)C)))nn5-cccnCCCOCC6))))))n5
|
[C][C][Branch1][C][C][C@H1][O][C][C][C@H1][Ring1][Branch1][C][=N][C][Branch1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][=N][N][Ring1][#Branch2][C][C][=C][N][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][N][=Ring1][O]
|
c17nc4nn15.[C@H]13OCC[C@H]17.c15ccn6n1.C16CCOCC1.C4C(C)(C)C.CC3C
|
Cc1cc(C(=O)N[C@H](CC(=O)N2CC3(CC(O)C3)C2)CC2CC2)cnn1
|
CcccC=O)N[C@H]CC=O)NCCCCO)C4)))C4))))))CCCC3)))))))cnn6
|
[C][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch2][C][C][Branch1][C][O][C][Ring1][Branch1][C][Ring1][Branch2][C][C][C][C][Ring1][Ring1][=C][N][=N][Ring2][Ring1][=Branch2]
|
N15CC2(CC(O)C2)C1.Cc1cc7cnn1.[C@H]6(C8)CC5=O.C47=O.C18CC1.N46
|
C=C1CC(CC(=O)N2C[C@H](NC(=O)C[C@@H](CC)CCC)C(C)(C)C2)C1
|
C=CCCCC=O)NC[C@H]NC=O)C[C@@H]CC))CCC)))))))CC)C)C5)))))))C4
|
[C][=C][C][C][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][Ring1][C][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][P][C][Ring2][Ring1][Branch2]
|
C4(=O)C[C@@H](CC)CCC.N13C[C@H]5C(C)(C)C1.C=C1CC6C1.C6C3=O.N45
|
CCO[C@H](C(=O)N1CCC(F)(F)[C@H](CNC(=O)c2csc(Cl)c2)C1)C1CCC1
|
CCO[C@H]C=O)NCCCF)F)[C@H]CNC=O)ccscCl)c5))))))))C6)))))))CCCC4
|
[C][C][O][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Cl][=C][Ring1][=Branch1][C][Ring2][Ring1][C][C][C][C][C][Ring1][Ring2]
|
N13CCC(F)(F)[C@H]%10C1.c18csc(Cl)c1.[C@H]69C3=O.C19CCC1.C48=O.CC5.O56.C7%10.N47
|
CC(C)C1(C(=O)NC[C@@H]2CCC[C@H](CNC(=O)[C@H](F)C(F)(F)C(F)(F)F)C2)CC1
|
CCC)CC=O)NC[C@@H]CCC[C@H]CNC=O)[C@H]F)CF)F)CF)F)F)))))))C6)))))))))CC3
|
[C][C][Branch1][C][C][C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@H1][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][#Branch2]
|
C4(=O)[C@H](F)C(F)(F)C(F)(F)F.[C@@H]19CCC[C@H]%10C1.C178CC1.CC8C.C37=O.N35.C59.C6%10.N46
|
COC[C@@H]1CCCN(C(=O)[C@H]2CCCN(C(=O)CNC3CC3)CC2)C1
|
COC[C@@H]CCCNC=O)[C@H]CCCNC=O)CNCCC3))))))CC7))))))))C6
|
[C][O][C][C@@H1][C][C][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][N][C][C][C][Ring1][Ring1][C][C][Ring1][=C][C][Ring2][Ring1][=Branch1]
|
[C@H]19CCCN5CC1.[C@@H]1%10CCCN4C1.C5(=O)C7.C49=O.C18CC1.CO6.C6%10.N78
|
COC[C@](C)(O)CC(=O)NC[C@H]1CN(C(=O)C=Cc2cncnc2O)C[C@@H]1C
|
COC[C@]C)O)CC=O)NC[C@H]CNC=O)C=Cccncnc6O))))))))))C[C@@H]5C
|
[C][O][C][C@][Branch1][C][C][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][N][=C][N][=C][Ring1][=Branch1][O][C][C@@H1][Ring1][S][C]
|
C5[C@](C)(O)CC3=O.C=7c1cncnc1O.[C@H]18CN4C[C@@H]1C.C4(=O)C=7.CO5.N36.C68
|
C/C=C/C[C@H](C)C(=O)N1CC(COC)(NC(=O)c2cc3c(O)cc(Cl)cc3[nH]2)C1
|
C/C=C/C[C@H]C)C=O)NCCCOC)))NC=O)ccccO)ccCl)cc6[nH]9)))))))))))C4
|
[C][/C][=C][/C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][O][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][NH1][Ring1][O][C][Ring2][Ring1][Branch1]
|
c18cc2c(O)cc(Cl)cc2[nH]1.C=9C[C@H](C)C4=O.N14CC7%10C1.C58=O.CC=9.C6%10.O6C.N57
|
C[C@H](CO)Cn1nc([C@H]2CN(C)CCO2)nc1-c1cc2cccnc2s1
|
C[C@H]CO))Cnnc[C@H]CNC)CCO6))))))nc5-ccccccnc6s9
|
[C][C@H1][Branch1][Ring1][C][O][C][N][N][=C][Branch1][N][C@H1][C][N][Branch1][C][C][C][C][O][Ring1][#Branch1][N][=C][Ring1][N][C][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][S][Ring1][=Branch2]
|
c15cc2cccnc2s1.n13nc4nc15.[C@H]14CN(C)CCO1.C[C@@H](C3)CO
|
C[C@@H]1CCCC[C@H]1CNC(=O)C(C)(C)CCCNC(=O)CNC(=O)C(C)(C)C
|
C[C@@H]CCCC[C@H]6CNC=O)CC)C)CCCNC=O)CNC=O)CC)C)C
|
[C][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C]
|
C2(=O)C(C)(C)CCC6.C[C@@H]1CCCC[C@H]18.C4(=O)C(C)(C)C.C3(=O)C7.C58.N25.N36.N47
|
CO[C@@H]1CC[C@]2(C(=O)N3C[C@H](C)C[C@H](C(=O)N4CC5(CSC5)C4)C3)C[C@@H]12
|
CO[C@@H]CC[C@]C=O)NC[C@H]C)C[C@H]C=O)NCCCSC4)))C4)))))C6)))))))C[C@@H]63
|
[C][O][C@@H1][C][C][C@][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][C][S][C][Ring1][Ring2][C][Ring1][#Branch1][C][Ring1][S][C][C@@H1][Ring2][Ring1][Branch2][Ring2][Ring1][Branch1]
|
N16C[C@@H]%10C[C@@H](C)C1.[C@@H]18CC[C@]29C[C@@H]12.N17CC2(CSC2)C1.C69=O.C7%10=O.CO8
|
CC(C)OC1CCC(NS(=O)(=O)c2ccc(N3CCC(O)CC3)c(F)c2)CC1
|
CCC)OCCCCNS=O)=O)ccccNCCCO)CC6))))))cF)c6))))))))CC6
|
[C][C][Branch1][C][C][O][C][C][C][C][Branch2][Ring1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][N][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][C][Branch1][C][F][=C][Ring1][=C][C][C][Ring2][Ring1][Branch2]
|
S6(=O)(=O)c1ccc7c(F)c1.C15CCC8CC1.N17CCC(O)CC1.CC4C.O45.N68
|
CCn1cc(C(=O)N2[C@@H]3CC[C@@H](C3)[C@H]2C(=O)NCC2(O)CN(C)C2)nn1
|
CCnccC=O)N[C@@H]CC[C@@H]C5)[C@H]6C=O)NCCO)CNC)C4))))))))))))))nn5
|
[C][C][N][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch1][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][N][Branch1][C][C][C][Ring1][=Branch1][N][=N][Ring2][Ring1][Branch2]
|
N14[C@@H]2CC[C@@H](C2)[C@H]17.n19cc8nn1.C1%10(O)CN(C)C1.C48=O.C57=O.CC9.N56.C6%10
|
Cc1nnc(C(=O)N[C@@H]2C[C@H]3CN(C(=O)c4ccc5c(c4)COB5O)C[C@@H]32)s1
|
CcnncC=O)N[C@@H]C[C@H]CNC=O)cccccc6)COB5O))))))))))C[C@@H]57)))))))))s5
|
[C][C][=N][N][=C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][O][B][Ring1][=Branch1][O][C][C@@H1][Ring1][P][Ring2][Ring1][Ring1][S][Ring2][Ring1][O]
|
c1%10ccc2c(c1)COB2O.[C@@H]18C[C@H]2CN7C[C@@H]21.Cc1nnc9s1.C69=O.C7%10=O.N68
|
C#CCn1c(C)cc(C(=O)N[C@@H]2CC[C@@H]2NC(=O)CSCC(N)=O)c1C
|
C#CCncC)ccC=O)N[C@@H]CC[C@@H]4NC=O)CSCCN)=O)))))))))))))c5C
|
[C][#C][C][N][C][Branch1][C][C][=C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][S][C][C][Branch1][C][N][=O][=C][Ring2][Ring1][=Branch1][C]
|
n1%10c(C)cc9c1C.[C@@H]17CC[C@@H]18.C4(=O)C5.C6C(N)=O.C#CC%10.C39=O.N37.N48.S56
|
C[C@H](CCNC(=O)c1c(F)ccc(Cl)c1N)NC(=O)c1scc2c1OCCO2
|
C[C@H]CCNC=O)ccF)cccCl)c6N)))))))))))NC=O)csccc5OCCO6
|
[C][C@H1][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][N][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][O][C][C][O][Ring1][=Branch1]
|
c18c(F)ccc(Cl)c1N.c17scc2c1OCCO2.C[C@@H]5CC6.C38=O.C47=O.N36.N45
|
Cc1cn(C)cc1C(=O)N[C@H](C(C)C)C1CCN(C(=O)c2ncccc2N)CC1
|
CccnC)cc5C=O)N[C@H]CC)C))CCCNC=O)cncccc6N))))))))CC6
|
[C][C][=C][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][N][C][C][Ring1][#C]
|
Cc1cn(C)cc17.C18CCN4CC1.c16ncccc1N.[C@H]58C(C)C.C37=O.C46=O.N35
|
O=C(N[C@@]12CCC[C@@H](C[C@@H]1CO)C2)[C@H]1CCCN(S(=O)(=O)C(F)(F)F)C1
|
O=CN[C@@]CCC[C@@H]C[C@@H]7CO))))C6)))))))[C@H]CCCNS=O)=O)CF)F)F)))C6
|
[O][=C][Branch2][Ring1][C][N][C@@][C][C][C][C@@H1][Branch1][#Branch1][C][C@@H1][Ring1][#Branch1][C][O][C][Ring1][#Branch2][C@H1][C][C][C][N][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=N]
|
[C@@]125CCC[C@@H](C[C@@H]17)C2.[C@H]16CCCN4C1.S4(=O)(=O)C(F)(F)F.O=C36.N35.C7O
|
COCCCNC(=O)[C@H](c1nc(C(F)(F)F)cs1)N1C[C@@H](C)OCC(C)(C)C1
|
COCCCNC=O)[C@H]cncCF)F)F))cs5)))))NC[C@@H]C)OCCC)C)C7
|
[C][O][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch2][Ring1][C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][S][Ring1][=Branch2][N][C][C@@H1][Branch1][C][C][O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2]
|
N15C[C@@H](C)OCC(C)(C)C1.c16nc7cs1.C2(=O)[C@@H]56.C3CC4.C7(F)(F)F.CO3.N24
|
C#CCN(C(=O)[C@H](CC)N(CC)CC)C1CCN(C(=O)c2ccn(C)n2)CC1
|
C#CCNC=O)[C@H]CC))NCC))CC)))))CCCNC=O)cccnC)n5))))))CC6
|
[C][#C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][C][N][Branch1][Ring1][C][C][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][C][Ring1][=C]
|
C19CCN4CC1.C3(=O)[C@@H]6CC.c1%10ccn(C)n1.C#CC5.N359.N678.C4%10=O.C7C.C8C
|
Cc1cccc(C(=O)N2C[C@@H]3[C@H](C2)[C@@H]3C(=O)NCc2cc(Br)no2)c1Br
|
CcccccC=O)NC[C@@H][C@H]C5)[C@@H]3C=O)NCcccBr)no5))))))))))))))c6Br
|
[C][C][=C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][C][Br][=N][O][Ring1][=Branch1][=C][Ring2][Ring1][Branch2][Br]
|
Cc1cccc8c1Br.N14C[C@@H]2[C@H]7[C@@H]2C1.c19cc(Br)no1.C48=O.C57=O.N56.C69
|
Cc1ncc(Br)c(=NCCCc2nc(-c3ccccc3)no2)[nH]1
|
CcnccBr)c=NCCCcnc-cccccc6))))))no5)))))))))[nH]6
|
[C][C][=N][C][=C][Branch1][C][Br][C][=Branch2][Ring1][=Branch1][=N][C][C][C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][O][Ring1][O][NH1][Ring2][Ring1][=Branch1]
|
Cc1ncc(Br)c(=NCCC4)[nH]1.c14nc5no1.c15ccccc1
|
CCCCNC(=O)[C@H](c1cc(C2(C)CC2)on1)N1CCC[C@@H](c2cccnc2)C1
|
CCCCNC=O)[C@H]cccCC)CC3)))on5)))))NCCC[C@@H]ccccnc6))))))C6
|
[C][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch2][Ring1][C][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][C][C][Ring1][Ring2][O][N][=Ring1][=Branch2][N][C][C][C][C@@H1][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][N]
|
N15CCC[C@@H]8C1.c16cc7on1.c18cccnc1.C3(=O)[C@@H]56.CCCC4.C17(C)CC1.N34
|
CCn1nc(C(=O)N2CCC[C@H](Nc3ncnc4c(Br)nn(C)c34)CC2)cc1C
|
CCnncC=O)NCCC[C@H]NcncnccBr)nnC)c95))))))))))CC7))))))))cc5C
|
[C][C][N][N][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Branch1][N][C][=N][C][=N][C][C][Branch1][C][Br][=N][N][Branch1][C][C][C][Ring1][O][=Ring1][#Branch1][C][C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch2][C]
|
c16ncnc2c(Br)nn(C)c12.N15CCC[C@H]7CC1.n19nc8cc1C.C58=O.CC9.N67
|
CC[C@H](C)[C@@H](NC(=O)[C@@H]1[C@@H]2CN(Cc3cc(Cl)cc(Br)c3)C[C@@H]21)c1ccccc1
|
CC[C@H]C)[C@@H]NC=O)[C@@H][C@@H]CNCcccCl)ccBr)c6)))))))C[C@@H]56))))))))cccccc6
|
[C][C][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@@H1][C@@H1][C][N][Branch1][S][C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Br][=C][Ring1][Branch2][C][C@@H1][Ring1][=C][Ring1][#C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
c19cc(Cl)cc(Br)c1.[C@H]17[C@H]2CN6C[C@@H]12.CC[C@H](C)[C@@H]58.c18ccccc1.C47=O.N45.C69
|
C=C=C(C)CC(=O)N1CCCCC(NC(=O)c2cc3c(C#N)c(F)ccc3[nH]2)C1
|
C=C=CC)CC=O)NCCCCCNC=O)ccccC#N))cF)ccc6[nH]9)))))))))))C7
|
[C][=C][=C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][C][F][=C][C][=C][Ring1][=Branch2][NH1][Ring1][N][C][Ring2][Ring1][=Branch1]
|
c17cc2c(C#N)c(F)ccc2[nH]1.N14CCCCC6C1.C=C=C(C)CC4=O.C57=O.N56
|
CCn1cccc1C(=O)NCC1(Nc2nc(Cl)nc3[nH]c(O)nc23)CCC1
|
CCncccc5C=O)NCCNcncCl)nc[nH]cO)nc95))))))))))CCC4
|
[C][C][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][N][C][=N][C][Branch1][C][Cl][=N][C][NH1][C][Branch1][C][O][=N][C][Ring1][O][=Ring1][=Branch1][C][C][C][Ring1][S]
|
c17nc(Cl)nc2[nH]c(O)nc12.n19cccc18.C16%10CCC1.C48=O.CC9.N45.C5%10.N67
|
C[C@H]1CN(C(=O)CN(C)S(N)(=O)=O)C[C@@H]1CCNC(=O)C[C@H]1CCCN1C
|
C[C@H]CNC=O)CNC)SN)=O)=O)))))C[C@@H]5CCNC=O)C[C@H]CCCN5C
|
[C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][N][Branch1][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][C@@H1][Ring1][=C][C][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][N][Ring1][Branch1][C]
|
C[C@H]1CN2C[C@@H]17.N4(C)S(N)(=O)=O.[C@H]16CCCN1C.C2(=O)C4.C3(=O)C6.C7C5.N35
|
CCN(C(=O)Cn1nc(C)oc1=O)[C@@H](C)C(=O)N1CCC[C@H](N=[N+]=[N-])C1
|
CCNC=O)CnncC)oc5=O))))))))[C@@H]C)C=O)NCCC[C@H]N=[N+]=[N-])))C6
|
[C][C][N][Branch1][P][C][=Branch1][C][=O][C][N][N][=C][Branch1][C][C][O][C][Ring1][=Branch1][=O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][Ring2][N][=N+1][=N-1][C][Ring1][=Branch2]
|
N13CCC[C@H](N=[N+]=[N-])C1.n16nc(C)oc1=O.[C@H]5(C)C3=O.C2(=O)C6.N245.CC4
|
CCc1cccnc1C(=O)N1Cc2ccccc2[C@H](CNC(=O)[C@H](O)CSC)C1
|
CCccccnc6C=O)NCcccccc6[C@H]CNC=O)[C@H]O)CSC)))))))C%10
|
[C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][S][C][C][Ring2][Ring1][Ring1]
|
N13Cc2ccccc2[C@H](C5)C1.c18cccnc17.C4(=O)[C@H](O)C6.C37=O.CC8.N45.S6C
|
C=CC1(C(=O)NC[C@@]2(CNC(=O)CC[C@@H](C)SC)CC23CCC3)CCOCC1
|
C=CCC=O)NC[C@@]CNC=O)CC[C@@H]C)SC))))))))CC3CCC4)))))))))CCOCC6
|
[C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][C@@H1][Branch1][C][C][S][C][C][C][Ring1][=N][C][C][C][Ring1][Ring2][C][C][O][C][C][Ring2][Ring1][#Branch2]
|
C=CC19CCOCC1.[C@]1%10%11CC12CCC2.C5(=O)CC[C@H]8C.C49=O.N46.C6%10.C7%11.N57.S8C
|
CC(C)CCCOCC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)CP(C)(C)=O
|
CCC)CCCOCC=O)NC[C@@H]F)C[C@H]5CNC=O)CPC)C)=O
|
[C][C][Branch1][C][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][F][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][P][Branch1][C][C][Branch1][C][C][=O]
|
N12C[C@@H](F)C[C@H]17.C3(=O)CP(C)(C)=O.CC(C)CCC4.C5C2=O.O45.C67.N36
|
O=C(NC[C@@H]1CC(F)(F)CN1C(=O)c1cc([N+](=O)[O-])c[nH]1)c1cnccc1Cl
|
O=CNC[C@@H]CCF)F)CN5C=O)ccc[N+]=O)[O-]))c[nH]5)))))))))))))ccnccc6Cl
|
[O][=C][Branch2][Ring2][C][N][C][C@@H1][C][C][Branch1][C][F][Branch1][C][F][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][NH1][Ring1][Branch2][C][=C][N][=C][C][=C][Ring1][=Branch1][Cl]
|
[C@@H]17CC(F)(F)CN13.c15cc([N+](=O)[O-])c[nH]1.c16cnccc1Cl.O=C26.C35=O.N24.C47
|
CCC[C@@H](CC)CCC(=O)N1CC(CCNC(=O)c2c[nH]nc2-c2ccco2)C1
|
CCC[C@@H]CC))CCC=O)NCCCCNC=O)cc[nH]nc5-cccco5))))))))))))))C4
|
[C][C][C][C@@H1][Branch1][Ring1][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C][=C][C][=C][O][Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
CCC[C@@H](CC)CCC3=O.c16c[nH]nc18.N13CC7C1.c18ccco1.C7C5.C46=O.N45
|
CN1CCOc2c(C(=O)N[C@H]3CCC[C@@H](NC(=O)[C@H](O)C(C)(C)C)C3)cccc21
|
CNCCOccC=O)N[C@H]CCC[C@@H]NC=O)[C@H]O)CC)C)C)))))C6))))))))cccc6%10
|
[C][N][C][C][O][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#C][C][=C][C][=C][Ring2][Ring1][Branch2][Ring2][Ring1][N]
|
CN1CCOc2c8cccc21.C5(=O)[C@H](O)C(C)(C)C.[C@H]16CCC[C@@H]7C1.C48=O.N46.N57
|
CN(C(=O)[C@H]1CCCC[C@@]1(C)NC(=O)CC1COCCOC1)C1CCCCCC1
|
CNC=O)[C@H]CCCC[C@@]6C)NC=O)CCCOCCOC7)))))))))))))))))CCCCCCC7
|
[C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C@H1][C][C][C][C][C@@][Ring1][=Branch1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][O][C][C][O][C][Ring1][#Branch1][C][C][C][C][C][C][C][Ring1][#Branch1]
|
[C@H]16CCCC[C@]14C.C17COCCOC1.C15CCCCCC1.C3(=O)C7.CN25.C26=O.N34
|
CC(C)[C@@H](C)CCNC(=O)[C@@H]1CCN1C(=O)c1cccn2ccnc12
|
CCC)[C@@H]C)CCNC=O)[C@@H]CCN4C=O)ccccnccnc95
|
[C][C][Branch1][C][C][C@@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][N][C][=C][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
c17cccn2ccnc12.CC(C)[C@@H](C)CC5.[C@@H]16CCN14.C36=O.C47=O.N35
|
CCC1=NO[C@H](C(=O)N2CCC[C@H](N(C)C(=O)c3cccn4nnnc34)CC2)C1
|
CCC=NO[C@H]C=O)NCCC[C@H]NC)C=O)ccccnnnnc95)))))))))))CC7))))))))C5
|
[C][C][C][=N][O][C@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][N][N][=N][N][=C][Ring1][=Branch2][Ring1][Branch1][C][C][Ring2][Ring1][Ring2][C][Ring2][Ring1][O]
|
c19cccn2nnnc12.N15CCC[C@H]7CC1.CCC1=NO[C@H]8C1.C58=O.N67C.C69=O
|
C#CCCCCCC(=O)N1CCC2(CC1)C[C@H]2C(=O)NCC(CC)CC
|
C#CCCCCCC=O)NCCCCC6))C[C@H]3C=O)NCCCC))CC
|
[C][#C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][C][C][C]
|
C#CCCCCCC3=O.N13CCC2(CC1)C[C@H]26.C5C(CC)CC.C46=O.N45
|
COC[C@@H](OC)C(=O)N1CCC2(CC(NC(=O)c3cc([N+](=O)[O-])cnc3O)C2)C1
|
COC[C@@H]OC))C=O)NCCCCCNC=O)ccc[N+]=O)[O-]))cnc6O)))))))))C4)))C5
|
[C][O][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=C][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][N][=C][Ring1][=Branch2][O][C][Ring1][P][C][Ring2][Ring1][Branch1]
|
c19cc([N+](=O)[O-])cnc1O.N14CCC2(CC8C2)C1.C6[C@@H]7C4=O.C59=O.CO6.O7C.N58
|
CN(CC(C)(C)NC(=O)Cc1ccc(F)cc1F)C(=O)[C@@]1(C)CC1(F)F
|
CNCCC)C)NC=O)CccccF)cc6F))))))))))))C=O)[C@@]C)CC3F)F
|
[C][N][Branch2][Ring1][O][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][F][F]
|
c17ccc(F)cc1F.[C@]16(C)CC1(F)F.C4C5(C)C.C2(=O)C7.CN34.C36=O.N25
|
CO[C@@](C)(C(=O)N(C)C[C@H](C)NC(=O)c1c(C)ncn1O)C1CC1
|
CO[C@@]C)C=O)NC)C[C@H]C)NC=O)ccC)ncn5O))))))))))))CCC3
|
[C][O][C@@][Branch1][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][=C][N][Ring1][=Branch1][O][C][C][C][Ring1][Ring1]
|
c17c(C)ncn1O.[C@@]48(C)C2=O.C5[C@@H]6C.N25C.C37=O.C18CC1.CO4.N36
|
CC[C@H]1CCOCCN1C(=O)[C@H]1CN(C(=O)CCc2conc2C)CC1(F)F
|
CC[C@H]CCOCCN7C=O)[C@H]CNC=O)CCcconc5C)))))))))CC5F)F
|
[C][C][C@H1][C][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][=C][O][N][=C][Ring1][Branch1][C][C][C][Ring1][#C][Branch1][C][F][F]
|
[C@H]16CCOCCN13.[C@H]15CN4CC1(F)F.c17conc1C.C4(=O)CC7.C35=O.CC6
|
CC(C)(C)[C@H](O)C(=O)N1CC[C@]2(C=C(C(=O)NC3CC4(CC4)C3)C2)C1
|
CCC)C)[C@H]O)C=O)NCC[C@]C=CC=O)NCCCCC3))C4))))))C4)))C5
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C@][Branch2][Ring1][#Branch2][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=Branch1][C][Ring1][=N][C][Ring1][P]
|
N15CC[C@]2(C=C(C6=O)C2)C1.CC(C)(C)[C@H](O)C5=O.C17CC2(CC2)C1.N67
|
CCc1cc(C(=O)NC[C@H]2[C@@H](C)CCN2C(=O)c2cnc(Cl)[nH]2)c(C)nn1
|
CCcccC=O)NC[C@H][C@@H]C)CCN5C=O)ccncCl)[nH]5))))))))))))))cC)nn6
|
[C][C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][C@@H1][Branch1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Cl][NH1][Ring1][=Branch1][=C][Branch1][C][C][N][=N][Ring2][Ring1][=Branch2]
|
c19cc7c(C)nn1.[C@H]18[C@@H](C)CCN14.c16cnc(Cl)[nH]1.C37=O.C46=O.CC9.N35.C58
|
CC(C)(C)[C@H](O)C(=O)N1C[C@H]2C[C@@H](C1)N(C(=O)CCCC1CCCC1)C2
|
CCC)C)[C@H]O)C=O)NC[C@H]C[C@@H]C6)NC=O)CCCCCCCC5)))))))))C5
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][Ring1][Branch1][C][Ring1][S]
|
N13C[C@H]2C[C@@H](C1)N4C2.CC(C)(C)[C@H](O)C3=O.C4(=O)CCC5.C15CCCC1
|
COC(=O)NCC(=O)N1CC[C@@H]2CN(C(=O)c3ccc[n+]([O-])c3)[C@H]2C1
|
COC=O)NCC=O)NCC[C@@H]CNC=O)cccc[n+][O-])c6)))))))[C@H]4C8
|
[C][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][N+1][Branch1][C][O-1][=C][Ring1][#Branch1][C@H1][Ring1][=N][C][Ring1][P]
|
N16CC[C@@H]2CN7[C@H]2C1.c19ccc[n+]([O-])c1.C8C6=O.C45=O.C79=O.CO4.N58
|
O[C@@H](C(F)F)C1CCN(CCCCCCCl)CC1
|
O[C@@H]CF)F))CCCNCCCCCCCl)))))))CC6
|
[O][C@@H1][Branch1][=Branch1][C][Branch1][C][F][F][C][C][C][N][Branch1][Branch2][C][C][C][C][C][C][Cl][C][C][Ring1][=N]
|
C13CCN2CC1.C2CCCCCCl.O[C@H]3C(F)F
|
Cc1ccc(C(C)C)cc1N[C@H](c1ccn(C(C)(C)C)c1)c1nnnn1C1CC1
|
CccccCC)C))cc6N[C@H]cccnCC)C)C))c5)))))cnnnn5CCC3
|
[C][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][=Branch2][N][C@H1][Branch2][Ring1][C][C][C][=C][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][=Branch2][C][=N][N][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
Cc1ccc6cc13.c17ccn4c1.c15nnnn18.C4(C)(C)C.C6(C)C.[C@H]257.C18CC1.N23
|
Cc1cc(O)ccc1CC(=O)N1CC2(CC2)C[C@@H]1CNC(=O)[C@H]1CCCCS1
|
CcccO)ccc6CC=O)NCCCC3))C[C@@H]5CNC=O)[C@H]CCCCS6
|
[C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][C@@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][S][Ring1][=Branch1]
|
Cc1cc(O)ccc18.N13CC2(CC2)C[C@@H]17.[C@H]16CCCCS1.C8C3=O.C46=O.C57.N45
|
C=CCC1(NC(=O)c2cc(Br)cs2)CN(C(=O)c2ncccc2C2CC2)C1
|
C=CCCNC=O)cccBr)cs5)))))))CNC=O)cncccc6CCC3))))))))))C4
|
[C][=C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][S][Ring1][=Branch1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Branch2]
|
c17ncccc19.C158CN4C1.c16cc(Br)cs1.C=CC8.C36=O.C47=O.C19CC1.N35
|
CC(C)[C@@H](O)C(=O)N1CC[C@H](NC(=O)C(C)(C)C)[C@H]1C
|
CCC)[C@@H]O)C=O)NCC[C@H]NC=O)CC)C)C))))[C@H]5C
|
[C][C][Branch1][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C@H1][Ring1][N][C]
|
CC(C)[C@@H](O)C2=O.N12CC[C@H]4[C@H]1C.C3(=O)C(C)(C)C.N34
|
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