SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
COc1cc(C)c(NC(=O)c2n[nH]cc2NCc2ccc(C(N)=O)cc2)cn1
|
COcccC)cNC=O)cn[nH]cc5NCccccCN)=O))cc6)))))))))))))))cn6
|
[C][O][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][N][C][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][=N][Ring2][Ring1][#Branch2]
|
c14cc(C)c6cn1.c1%10ccc9cc1.c18n[nH]cc17.C38=O.C9(N)=O.CO4.N36.N57.C5%10
|
O=C(C(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2)N1CC[C@@]2(O)CCOC[C@H]2C1
|
O=CC=O)N[C@H]CC[C@H]5CCF)F)C7)))))))))NCC[C@@]O)CCOC[C@H]6C%10
|
[O][=C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch2][N][C][C][C@@][Branch1][C][O][C][C][O][C][C@H1][Ring1][#Branch1][C][Ring1][O]
|
N13CC[C@@]2(O)CCOC[C@H]2C1.N14[C@H]2CC[C@H]1CC(F)(F)C2.O=C3C4=O
|
C=CCCCc1ccc(C(=O)N2C[C@@H](N(C)C)[C@@H](O)C2)cc1
|
C=CCCCccccC=O)NC[C@@H]NC)C))[C@@H]O)C5))))))cc6
|
[C][=C][C][C][C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@@H1][Branch1][C][O][C][Ring1][=Branch2][C][=C][Ring1][P]
|
c16ccc5cc1.N13C[C@@H]4[C@@H](O)C1.C=CCCC6.C35=O.N4(C)C
|
C[C@@H]1CCCN1C(=O)[C@@]12C[C@H](n3cc(-c4ccc(C#N)nc4)nn3)[C@@H]1C2
|
C[C@@H]CCCN5C=O)[C@@]C[C@H]ncc-ccccC#N))nc6))))))nn5)))))[C@@H]4C5
|
[C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@][C][C@H1][Branch2][Ring1][=Branch1][N][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][C][#N][N][=C][Ring1][Branch2][N][=N][Ring1][=N][C@@H1][Ring1][P][C][Ring2][Ring1][C]
|
c18ccc(C#N)nc1.C[C@@H]1CCCN15.[C@@]126C[C@H]7[C@@H]1C2.n17cc8nn1.C56=O
|
C[C@H](CNC(=O)[C@@H](O)Cc1cnc[nH]1)N(C)C(=O)CC(Cl)Cl
|
C[C@H]CNC=O)[C@@H]O)Cccnc[nH]5))))))))))NC)C=O)CCCl)Cl
|
[C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][=C][N][=C][NH1][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch1][C][Cl][Cl]
|
C2(=O)[C@@H](O)C6.C3(=O)CC(Cl)Cl.c16cnc[nH]1.C[C@@H]4C5.N34C.N25
|
Cc1ccc2c(C(=O)N(C)C[C@H](C)NC(=O)[C@H](C)n3cncn3)cnn2c1C
|
CcccccC=O)NC)C[C@H]C)NC=O)[C@H]C)ncncn5))))))))))))cnn5c9C
|
[C][C][C][=C][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@H1][Branch1][C][C][N][C][=N][C][=N][Ring1][Branch1][C][=N][N][Ring2][Ring1][=Branch1][C][=Ring2][Ring1][#Branch2][C]
|
Cc1ccc2c8cnn2c1C.C5(=O)[C@@H]9C.n19cncn1.C6[C@@H]7C.C48=O.N46C.N57
|
C[C@H](C(=O)N1C[C@H]2CC[C@@H]1[C@@H]2NC(=O)c1cnc2c(c1)CCCC2)n1ccnc1
|
C[C@H]C=O)NC[C@H]CC[C@@H]6[C@@H]5NC=O)ccnccc6)CCCC6)))))))))))))))))))nccnc5
|
[C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Ring1][=Branch1][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][C][Ring1][#Branch1][N][C][=C][N][=C][Ring1][Branch1]
|
c16cnc2c(c1)CCCC2.N13C[C@H]2CC[C@@H]1[C@@H]25.C[C@@H]7C3=O.n17ccnc1.C46=O.N45
|
CCOc1ccc(C(=O)N[C@H]2CC[C@H](CCN=c3ccc(C#N)c[nH]3)C2)cc1C
|
CCOccccC=O)N[C@H]CC[C@H]CCN=ccccC#N))c[nH]6)))))))))C5)))))))cc6C
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch1][S][C][C][N][=C][C][=C][C][Branch1][Ring1][C][#N][=C][NH1][Ring1][Branch2][C][Ring1][S][C][=C][Ring2][Ring1][=Branch2][C]
|
C9CN=c1ccc(C#N)c[nH]1.c16ccc8cc1C.[C@H]17CC[C@H]9C1.C48=O.CC5.O56.N47
|
CCOCCn1nnnc1[C@@H](NCc1ccc(S(C)(=O)=O)s1)c1ccc(CC)s1
|
CCOCCnnnnc5[C@@H]NCccccSC)=O)=O))s5)))))))ccccCC))s5
|
[C][C][O][C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch2][Ring1][Ring2][N][C][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][S][Ring1][=Branch2][C][=C][C][=C][Branch1][Ring1][C][C][S][Ring1][#Branch1]
|
c19ccc(S(C)(=O)=O)s1.n16nnnc17.c18ccc%10s1.C3C6.[C@@H]478.CC2.O23.N45.C59.C%10C
|
C[C@H](OC(C)(C)C)C(=O)N(C)[C@@H]1CCN(C(=O)[C@@H](F)CCC(C)(C)C)C1
|
C[C@H]OCC)C)C)))C=O)NC)[C@@H]CCNC=O)[C@@H]F)CCCC)C)C))))))C5
|
[C][C@H1][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#C]
|
C3(=O)[C@@H](F)CCC(C)(C)C.[C@@H]16CCN3C1.C[C@H]4C2=O.C5(C)(C)C.N26C.O45
|
COC(=O)[C@@H]1Cc2c(cnn2C)N(C(=O)c2cccc3c2NCCC3)C1
|
COC=O)[C@@H]Ccccnn5C))))NC=O)cccccc6NCCC6)))))))))))C6
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C][=C][Branch1][#Branch1][C][=N][N][Ring1][Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
[C@@H]16Cc2c(cnn2C)N5C1.c17cccc2c1NCCC2.C46=O.C57=O.CO4
|
CCc1c(O)nc(S[C@H](C#N)CCc2ccccc2)n(-c2cccnc2)c1=O
|
CCccO)ncS[C@H]C#N))CCcccccc6))))))))))n-ccccnc6))))))c6=O
|
[C][C][C][=C][Branch1][C][O][N][=C][Branch1][P][S][C@H1][Branch1][Ring1][C][#N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch2][=O]
|
c14c(O)nc7n6c1=O.[C@@H]3(C#N)CC5.c15ccccc1.c16cccnc1.CC4.S37
|
CC(C)[C@@H](O)[C@H](C)NC(=O)C1(NC(=O)CCC(C)(C)F)CCOCC1
|
CCC)[C@@H]O)[C@H]C)NC=O)CNC=O)CCCC)C)F))))))CCOCC6
|
[C][C][Branch1][C][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][S][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][F][C][C][O][C][C][Ring1][#C]
|
C3(=O)CCC(C)(C)F.CC(C)[C@@H](O)[C@@H]4C.C156CCOCC1.C26=O.N24.N35
|
CCn1cc(C(=O)NC[C@@H]2CC(F)(F)CN2C(=O)[C@H](C)NS(=O)(=O)CC)nn1
|
CCnccC=O)NC[C@@H]CCF)F)CN5C=O)[C@H]C)NS=O)=O)CC))))))))))))))nn5
|
[C][C][N][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch1][C][F][Branch1][C][F][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][N][=N][Ring2][Ring1][#Branch2]
|
[C@@H]1%10CC(F)(F)CN14.n19cc8nn1.C4(=O)[C@@H]6C.S7(=O)(=O)CC.C38=O.CC9.N35.C5%10.N67
|
Cc1nnn(CC(=O)NCc2cc(C(=O)N[C@@H]3COC[C@H]3C3CC3)co2)n1
|
CcnnnCC=O)NCcccC=O)N[C@@H]COC[C@H]5CCC3))))))))))co5)))))))))n5
|
[C][C][N][=N][N][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C@@H1][C][O][C][C@H1][Ring1][Branch1][C][C][C][Ring1][Ring1][=C][O][Ring1][S][N][=Ring2][Ring1][#Branch2]
|
[C@@H]17COC[C@H]1C1CC1.Cc1nnn9n1.c1%10cc8co1.C9C4=O.C58=O.N46.C6%10.N57
|
Cc1cc(F)c(N)cc1C(=O)NC[C@H](O)CNC(=O)c1c[nH]nc1-n1cnnn1
|
CcccF)cN)cc6C=O)NC[C@H]O)CNC=O)cc[nH]nc5-ncnnn5
|
[C][C][=C][C][Branch1][C][F][=C][Branch1][C][N][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][N][C][=N][N][=N][Ring1][Branch1]
|
Cc1cc(F)c(N)cc16.c17c[nH]nc18.C4[C@H](O)C5.n18cnnn1.C26=O.C37=O.N24.N35
|
CCN1CCC[C@H](C(=O)N[C@H](C(=O)NCc2csnn2)C2CC2)C1
|
CCNCCC[C@H]C=O)N[C@H]C=O)NCccsnn5))))))))CCC3))))))C6
|
[C][C][N][C][C][C][C@H1][Branch2][Ring1][O][C][=Branch1][C][=O][N][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C][C][=C][S][N][=N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][=Branch1]
|
N15CCC[C@H]8C1.[C@H]6%10C4=O.c19csnn1.C38=O.C1%10CC1.CC5.N36.N47.C79
|
CC(C)(C)[C@@H](CO)C(=O)N[C@@](C)(CO)CNC(=O)c1nnsc1-c1ccccc1
|
CCC)C)[C@@H]CO))C=O)N[C@@]C)CO))CNC=O)cnnsc5-cccccc6
|
[C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@][Branch1][C][C][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][N][=N][S][C][=Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
CC(C)(C)[C@@H](CO)C2=O.[C@]4(C)(C5)CO.c16nnsc17.c17ccccc1.C36=O.N24.N35
|
CC(=O)O[C@H](C(=O)NC[C@H](C)CNC(=O)c1cc(C2CC2)ccc1F)C(F)(F)F
|
CC=O)O[C@H]C=O)NC[C@H]C)CNC=O)cccCCC3)))ccc6F))))))))))))))CF)F)F
|
[C][C][=Branch1][C][=O][O][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][C][=C][Ring1][=Branch2][F][C][Branch1][C][F][Branch1][C][F][F]
|
[C@@H]6(C4=O)C(F)(F)F.c19cc%10ccc1F.C7[C@H](C)C8.CC3=O.C59=O.C1%10CC1.O36.N47.N58
|
CCN(C(=O)[C@@H]1C[C@@H]1C(F)F)[C@@H]1CCCN(C(=O)c2cc3scc(C)c3[nH]2)C1
|
CCNC=O)[C@@H]C[C@@H]3CF)F))))))[C@@H]CCCNC=O)cccsccC)c5[nH]8)))))))))C6
|
[C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][Branch1][C][F][F][C@@H1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][S][C][=C][Branch1][C][C][C][=Ring1][=Branch1][NH1][Ring1][=Branch2][C][Ring1][P]
|
c18cc2scc(C)c2[nH]1.[C@@H]17CCCN5C1.[C@@H]19C[C@@H]1%10.N467.C49=O.C%10(F)F.C58=O.CC6
|
CCc1cc(C(=O)N(Cc2ccccc2)Cc2nn[nH]n2)ccc1Br
|
CCcccC=O)NCcccccc6)))))))Ccnn[nH]n5))))))))ccc6Br
|
[C][C][C][=C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][=N][NH1][N][=Ring1][Branch1][=C][C][=C][Ring2][Ring1][=Branch1][Br]
|
c18cc6ccc1Br.c19ccccc1.c17nn[nH]n1.C36=O.N345.CC8.C49.C57
|
Cc1cc(C(=O)N[C@H]2CC=CC[C@H]2C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)cs1
|
CcccC=O)N[C@H]CC=CC[C@H]6C=O)NCCC[C@@H]N=[N+]=[N-])))CC7))))))))))))))))cs5
|
[C][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][C][C][=C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][Ring2][N][=N+1][=N-1][C][C][Ring1][#Branch2][=C][S][Ring2][Ring1][#Branch2]
|
N14CCC[C@@H](N=[N+]=[N-])CC1.[C@H]15CC=CC[C@H]16.Cc1cc7cs1.C37=O.C46=O.N35
|
CC#CCN(C)C(=O)[C@@]1(C)C=CCN1C(=O)[C@H]1C[C@H]2CC(=O)[C@H]1O2
|
CC#CCNC)C=O)[C@@]C)C=CCN5C=O)[C@H]C[C@H]CC=O)[C@H]6O5
|
[C][C][#C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@][Branch1][C][C][C][=C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C@H1][C][C][=Branch1][C][=O][C@H1][Ring1][#Branch1][O][Ring1][=Branch1]
|
[C@H]17C[C@H]2CC(=O)[C@H]1O2.[C@]16(C)C=CCN14.CC#CC5.N35C.C36=O.C47=O
|
O=C1CC(C(=O)N[C@@H]2CCC[C@H]2CC(=O)NCC2CCCCC2)(C2CC2)C1
|
O=CCCC=O)N[C@@H]CCC[C@H]5CC=O)NCCCCCCC6)))))))))))))))))CCC3)))C4
|
[O][=C][C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][Ring1][=Branch1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][#Branch2]
|
O=C1CC7(C2CC2)C1.[C@@H]16CCC[C@H]18.C19CCCCC1.C8C4=O.C37=O.N36.N45.C59
|
O=C(NC[C@]1(C2CC2)CCN(C(=O)[C@H](O)CF)C1)c1cccc(-n2cccn2)c1
|
O=CNC[C@]CCC3)))CCNC=O)[C@H]O)CF))))C5)))))))ccccc-ncccn5)))))c6
|
[O][=C][Branch2][Ring1][=N][N][C][C@][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][N][Branch1][O][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][F][C][Ring1][=C][C][=C][C][=C][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][=C][Ring1][O]
|
[C@@]17(C2CC2)CCN4C1.c16cccc8c1.C4(=O)[C@H](O)CF.n18cccn1.O=C36.N35.C57
|
CC(C)C[C@@H](O)C(=O)N(C)[C@@H](C)CCNC(=O)COc1ccc(Cl)nc1
|
CCC)C[C@@H]O)C=O)NC)[C@@H]C)CCNC=O)COccccCl)nc6
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1]
|
CC(C)C[C@@H](O)C2=O.c15ccc(Cl)nc1.[C@H]6(C)CC7.C3(=O)C4.N26C.N37.O45
|
COCCCS(=O)(=O)NCC(=O)N(C)[C@@H]1CCN(C(=O)c2cc(C)cc(N)c2)C1
|
COCCCS=O)=O)NCC=O)NC)[C@@H]CCNC=O)cccC)ccN)c6)))))))C5
|
[C][O][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][Branch1][C][N][=C][Ring1][Branch2][C][Ring1][#C]
|
c19cc(C)cc(N)c1.C5CCS7(=O)=O.[C@@H]18CCN4C1.C6C3=O.N38C.C49=O.CO5.N67
|
CN(CCOCCNC(=O)c1cn[nH]c1)C(=O)[C@@H]1CC12CCC2
|
CNCCOCCNC=O)ccn[nH]c5))))))))))))C=O)[C@@H]CC3CCC4
|
[C][N][Branch2][Ring1][C][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][=N][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][C][Ring1][Ring2]
|
[C@@H]19CC12CCC2.c1%10cn[nH]c1.CN47.C7C5.C6C8.C3%10=O.C49=O.O56.N38
|
CC[C@H](O)C(=O)NC1(c2ccccc2)CN(C(=O)[C@H]2C[C@@H](C)CC(=O)N2)C1
|
CC[C@H]O)C=O)NCcccccc6))))))CNC=O)[C@H]C[C@@H]C)CC=O)N6)))))))C4
|
[C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][Ring1][Branch2][C][Ring2][Ring1][Ring2]
|
[C@H]16C[C@@H](C)CC(=O)N1.CC[C@H](O)C3=O.C157CN4C1.c17ccccc1.C46=O.N35
|
C=CCCC[C@H](C)NC(=O)CN(C(=O)C1=Cc2ccccc2C1)C(C)C
|
C=CCCC[C@H]C)NC=O)CNC=O)C=Ccccccc6C9))))))))))CC)C
|
[C][=C][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][C][Branch1][C][C][C]
|
C4(=O)C1=Cc2ccccc2C1.C=CCCC[C@@H]5C.C3(=O)C6.N467.C7(C)C.N35
|
C[C@H]1C[C@H]2CN(C(=O)CCc3cscc3Br)CCN2C1
|
C[C@H]C[C@H]CNC=O)CCccscc5Br)))))))))CCN6C9
|
[C][C@H1][C][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][=C][S][C][=C][Ring1][Branch1][Br][C][C][N][Ring1][S][C][Ring2][Ring1][Ring1]
|
C[C@H]1C[C@H]2CN4CCN2C1.c15cscc1Br.C4(=O)CC5
|
CC1(C)CN(C(=O)c2cnc(N)c(Cl)c2)CC[C@H]1NC(=O)C[C@H]1COCCO1
|
CCC)CNC=O)ccncN)cCl)c6)))))))CC[C@H]6NC=O)C[C@H]COCCO6
|
[C][C][Branch1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][N][C][Branch1][C][Cl][=C][Ring1][Branch2][C][C][C@H1][Ring1][P][N][C][=Branch1][C][=O][C][C@H1][C][O][C][C][O][Ring1][=Branch1]
|
CC1(C)CN3CC[C@H]15.c16cnc(N)c(Cl)c1.[C@H]17COCCO1.C4(=O)C7.C36=O.N45
|
CC(C)(C)C(=O)NC[C@](C)(F)CNC(=O)c1cnn2c1NCCC2
|
CCC)C)C=O)NC[C@]C)F)CNC=O)ccnnc5NCCC6
|
[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][C][F][C][N][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][N][C][C][C][Ring1][=Branch1]
|
c17cnn2c1NCCC2.CC(C)(C)C3=O.C5[C@](C)(F)C6.C47=O.N35.N46
|
Cc1cccnc1C(=O)N1C[C@H]2C[C@@H](NC(=O)C3CC4(CSC4)C3)C[C@H]1C2
|
Cccccnc6C=O)NC[C@H]C[C@@H]NC=O)CCCCSC4)))C4))))))C[C@H]7C6
|
[C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][S][C][Ring1][Ring2][C][Ring1][#Branch1][C][C@H1][Ring1][P][C][Ring1][S]
|
N15C[C@H]2C[C@@H]7C[C@H]1C2.Cc1cccnc18.C19CC2(CSC2)C1.C58=O.C69=O.N67
|
C#CC[C@]1(O)C[C@@H](C(=O)N2CC3(C(=O)N4CCC[C@@H](OCC)C4)CCC2CC3)C1
|
C#CC[C@]O)C[C@@H]C=O)NCCC=O)NCCC[C@@H]OCC)))C6)))))))CCC6CC6)))))))))C4
|
[C][#C][C][C@][Branch1][C][O][C][C@@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][Ring2][O][C][C][C][Ring1][=Branch2][C][C][C][Ring1][P][C][C][Ring1][P][C][Ring2][Ring1][#Branch2]
|
N15CC2%10CCC1CC2.N16CCC[C@@H]8C1.[C@]1%11(O)C[C@H]9C1.C#CC%11.C59=O.C6%10=O.O78.C7C
|
CC1(C)[C@H](CC(=O)N2C[C@H]3C[C@H]2CN(C(=O)c2cccc4oncc24)C3)C[C@H]1O
|
CCC)[C@H]CC=O)NC[C@H]C[C@H]5CNC=O)ccccconcc95))))))))))C6))))))))))C[C@H]4O
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][O][N][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][Ring1][P][C][C@H1][Ring2][Ring1][O][O]
|
N15C[C@H]2C[C@H]1CN6C2.c17cccc2oncc12.CC1(C)[C@H]8C[C@H]1O.C8C5=O.C67=O
|
Cc1cc(F)cc(CC(=O)NC[C@]23CC[C@H]2CN(C(=O)[C@@H](O)c2ccco2)C3)c1
|
CcccF)ccCC=O)NC[C@]CC[C@H]4CNC=O)[C@@H]O)cccco5)))))))C7)))))))))))c6
|
[C][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][S][=C][Ring2][Ring1][N]
|
Cc1cc9cc(F)c1.[C@]128CC[C@H]1CN5C2.C5(=O)[C@H]7O.c17ccco1.C9C4=O.N46.C68
|
Cc1ccccc1C1(CNCCc2cc(Cl)cc(Cl)c2)CC1
|
Ccccccc6CCNCCcccCl)ccCl)c6))))))))))CC3
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring1][C][N][C][C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][C][C][Ring1][#C]
|
c16cc(Cl)cc(Cl)c1.Cc1ccccc17.C157CC1.C4C6.C35.N34
|
CCCC(C)=CC(=O)N1CCCC[C@H](NC(=O)c2coc3c2COC3)C1
|
CCCCC)=CC=O)NCCCC[C@H]NC=O)ccocc5COC5))))))))))C7
|
[C][C][C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][C][O][C][Ring1][Branch1][C][Ring2][Ring1][C]
|
N14CCCC[C@H]6C1.c17coc2c1COC2.CCCC=8C.C=8C4=O.C57=O.N56
|
COCc1nc2ccccn2c1C(=O)N1CC(NC(=O)CCc2csc(=N)[nH]2)C1
|
COCcncccccn6c9C=O)NCCNC=O)CCccsc=N)[nH]5)))))))))C4
|
[C][O][C][C][N][=C][C][=C][C][=C][N][Ring1][=Branch1][C][=Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=Branch1][C][=N][NH1][Ring1][=Branch1][C][Ring1][#C]
|
c18nc2ccccn2c17.c19csc(=N)[nH]1.N13CC6C1.C4(=O)CC9.C37=O.CO5.C58.N46
|
Cc1ccc(CC(=O)N[C@H]2CC[C@H](CN=c3nc(C#N)[nH]cc3Cl)C2)cc1C
|
CccccCC=O)N[C@H]CC[C@H]CN=cncC#N))[nH]cc6Cl)))))))))C5))))))))cc6C
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch1][S][C][N][=C][N][=C][Branch1][Ring1][C][#N][NH1][C][=C][Ring1][Branch2][Cl][C][Ring1][S][C][=C][Ring2][Ring1][#Branch2][C]
|
C6N=c1nc(C#N)[nH]cc1Cl.Cc1ccc7cc1C.[C@H]15CC[C@H]6C1.C7C4=O.N45
|
CN(CC1(CNC(=O)C=CCO)CC1)C(=O)c1cccc2c1OC(C)(C)C2
|
CNCCCNC=O)C=CCO)))))))CC3))))C=O)cccccc6OCC)C)C5
|
[C][N][Branch2][Ring1][Ring1][C][C][Branch1][O][C][N][C][=Branch1][C][=O][C][=C][C][O][C][C][Ring1][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1]
|
c17cccc2c1OC(C)(C)C2.C19%10CC1.C3(=O)C=8.CN45.C=8CO.C47=O.C59.C6%10.N36
|
C[C@H](Nc1ncnc(Cl)c1Br)[C@@H]1CN(C(=O)C(=O)NC2CC2)CCO1
|
C[C@H]NcncncCl)c6Br))))))))[C@@H]CNC=O)C=O)NCCC3))))))CCO6
|
[C][C@H1][Branch1][=C][N][C][=N][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][Br][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][C][O][Ring1][=C]
|
c16ncnc(Cl)c1Br.[C@@H]18CN3CCO1.C3(=O)C4=O.C[C@H]58.C17CC1.N56.N47
|
C/C(=C\c1ccc(C)o1)C(=O)N1CC2(CN(C(=O)CSC(=N)N)C2)C1
|
C/C=C\ccccC)o5))))))C=O)NCCCNC=O)CSC=N)N)))))C4)))C4
|
[C][/C][=Branch1][N][=C][\C][=C][C][=C][Branch1][C][C][O][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][C][N][Branch1][N][C][=Branch1][C][=O][C][S][C][=Branch1][C][=N][N][C][Ring1][O][C][Ring1][=C]
|
N13CC2(C1)CN4C2.C=6c1ccc(C)o1.CC=6C3=O.C4(=O)C5.S5C(=N)N
|
C#CCC1(NC(=O)CN(C(=O)c2cccc(C)n2)C2CC2)CCOCC1
|
C#CCCNC=O)CNC=O)cccccC)n6)))))))CCC3)))))))CCOCC6
|
[C][#C][C][C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][C][C][C][Ring1][Ring1][C][C][O][C][C][Ring2][Ring1][#Branch1]
|
C159CCOCC1.c18cccc(C)n1.C3(=O)C6.C#CC9.N467.C48=O.C17CC1.N35
|
CN1CCCC[C@@H]1CC(=O)NC[C@H]1C[C@@H](NC(=O)CSc2n[nH]c(O)n2)C1(C)C
|
CNCCCC[C@@H]6CC=O)NC[C@H]C[C@@H]NC=O)CScn[nH]cO)n5)))))))))C4C)C
|
[C][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][S][C][=N][NH1][C][Branch1][C][O][=N][Ring1][=Branch1][C][Ring1][#C][Branch1][C][C][C]
|
CN1CCCC[C@@H]18.[C@H]19C[C@@H]7C1(C)C.c1%10n[nH]c(O)n1.C8C3=O.C4(=O)C6.N35.C59.N47.S6%10
|
CN[C@@H]1CCC[C@H](NCc2c(Cl)nc3sccn23)C1
|
CN[C@@H]CCC[C@H]NCccCl)ncsccn85))))))))))C6
|
[C][N][C@@H1][C][C][C][C@H1][Branch2][Ring1][C][N][C][C][=C][Branch1][C][Cl][N][=C][S][C][=C][N][Ring1][=Branch2][Ring1][Branch1][C][Ring1][P]
|
c17c(Cl)nc2sccn12.[C@@H]15CCC[C@H]6C1.CN5.N46.C47
|
C/C(=C\c1ccccc1)C(=O)NC[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1cn(C)nn1
|
C/C=C\cccccc6)))))))C=O)NC[C@@H][C@@H]CCC3)))CCN5C=O)ccnC)nn5
|
[C][/C][=Branch1][#Branch2][=C][\C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1]
|
[C@@H]18[C@@H](C2CC2)CCN14.C=7c1ccccc1.c16cn(C)nn1.CC=7C3=O.C46=O.N35.C58
|
COc1cc(Cl)ccc1C(=O)N1C[C@H](NCc2ncc(C)s2)C2(CC2)C1
|
COcccCl)ccc6C=O)NC[C@H]NCcnccC)s5)))))))CCC3))C5
|
[C][O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][=N][N][C][C][=N][C][=C][Branch1][C][C][S][Ring1][=Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][#C]
|
c14cc(Cl)ccc17.N13C[C@H]6C2(CC2)C1.c18ncc(C)s1.C37=O.CO4.N56.C58
|
C/C=C/C(=O)N1CC[C@H](C(=O)Nc2cc(O)ccc2C)C1
|
C/C=C/C=O)NCC[C@H]C=O)NcccO)ccc6C)))))))))C5
|
[C][/C][=C][/C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][C][Ring1][S]
|
c15cc(O)ccc1C.N13CC[C@H]6C1.C=7C3=O.C46=O.CC=7.N45
|
O=C1C[C@H](NC(=O)C[C@@H]2CN(Cc3c(F)cccc3F)CCO2)CN1
|
O=CC[C@H]NC=O)C[C@@H]CNCccF)cccc6F))))))))CCO6)))))))))CN5
|
[O][=C][C][C@H1][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][C@@H1][C][N][Branch1][=C][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][C][O][Ring1][#C][C][N][Ring2][Ring1][Branch2]
|
c18c(F)cccc1F.[C@@H]17CN5CCO1.O=C1C[C@H]6CN1.C4(=O)C7.N46.C58
|
CCOC(C)(C)C(=O)NC[C@H]1CC[C@@](F)(CNC(=O)c2occc2C)CC1
|
CCOCC)C)C=O)NC[C@H]CC[C@@]F)CNC=O)coccc5C)))))))))CC6
|
[C][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@][Branch1][C][F][Branch1][#C][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][C][C][Ring1][P]
|
[C@H]1%10CC[C@]%11(F)CC1.C6(C)(C)C3=O.c19occc1C.C49=O.CC5.O56.N37.C7%10.C8%11.N48
|
C/C=C/C[C@@H](CC)C(=O)N(C)CC(C)(C)CNC(=O)c1ccc2nccnc2c1
|
C/C=C/C[C@@H]CC))C=O)NC)CCC)C)CNC=O)ccccnccnc6c%10
|
[C][/C][=C][/C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2]
|
c17ccc2nccnc2c1.C=8C[C@@H](CC)C3=O.C5C(C)(C)C6.N35C.C47=O.CC=8.N46
|
CC(C)(C)OC(=O)[C@]1(C)CC[C@H](NCCC2COC2)C1(C)C
|
CCC)C)OC=O)[C@]C)CC[C@H]NCCCCOC4)))))))C5C)C
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C@H1][Branch1][#Branch2][N][C][C][C][C][O][C][Ring1][Ring2][C][Ring1][=N][Branch1][C][C][C]
|
[C@@]17(C)CC[C@H]6C1(C)C.CC4(C)C.C18COC1.C37=O.C5C8.O34.N56
|
CCC[C@@H](C)[C@H](C(=O)Nc1ccc(F)cc1)N1CCCN(c2ccccc2)CC1
|
CCC[C@@H]C)[C@H]C=O)NccccF)cc6))))))))NCCCNcccccc6))))))CC7
|
[C][C][C][C@@H1][Branch1][C][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][C][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N]
|
CCC[C@@H](C)[C@@H]4C3=O.N14CCCN6CC1.c15ccc(F)cc1.c16ccccc1.N35
|
O=C(CCOC1COC1)NC[C@@H]1CCN1C(=O)C[C@@H]1CCCS(=O)(=O)C1
|
O=CCCOCCOC4)))))))NC[C@@H]CCN4C=O)C[C@@H]CCCS=O)=O)C6
|
[O][=C][Branch1][#Branch2][C][C][O][C][C][O][C][Ring1][Ring2][N][C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][C@@H1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][Branch2]
|
[C@@H]18CCCS(=O)(=O)C1.O=C2CC4.[C@@H]17CCN13.C15COC1.C3(=O)C8.O45.N26.C67
|
CC[C@@H]1C(=O)NCCN1C(=O)C[C@@H]1CCN(CCS(C)(=O)=O)C1
|
CC[C@@H]C=O)NCCN6C=O)C[C@@H]CCNCCSC)=O)=O))))C5
|
[C][C][C@@H1][C][=Branch1][C][=O][N][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C@@H1][C][C][N][Branch1][O][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][O]
|
[C@@H]14C(=O)NCCN12.[C@@H]15CCN3C1.C3CS(C)(=O)=O.C2(=O)C5.CC4
|
CC[C@@H](CN(C)CCCN(C)C)NC(=O)[C@H]1[C@@H](C(=O)OC(C)(C)C)C1(C)C
|
CC[C@@H]CNC)CCCNC)C)))))))NC=O)[C@H][C@@H]C=O)OCC)C)C))))C3C)C
|
[C][C][C@@H1][Branch1][=C][C][N][Branch1][C][C][C][C][C][N][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][C@@H1][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#Branch2][Branch1][C][C][C]
|
[C@H]19[C@@H]%10C1(C)C.CC[C@H]5C6.C7CC8.C4(C)(C)C.N67C.N8(C)C.C39=O.C2%10=O.N35.O24
|
CN(CCCCCNC(=O)[C@H]1C[C@]1(F)Cl)C(=O)Cc1cnn(C)c1
|
CNCCCCCNC=O)[C@H]C[C@]3F)Cl)))))))))))C=O)CccnnC)c5
|
[C][N][Branch2][Ring1][Ring2][C][C][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C@][Ring1][Ring1][Branch1][C][F][Cl][C][=Branch1][C][=O][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
C4CCCC5.c17cnn(C)c1.[C@H]16C[C@]1(F)Cl.C3(=O)C7.CN34.C26=O.N25
|
Cc1cc(CC(=O)N[C@H]2CCN(c3ncnc4sccc34)[C@@H]2C)on1
|
CcccCC=O)N[C@H]CCNcncncsccc95)))))))))[C@@H]5C)))))))))on5
|
[C][C][C][=C][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][=C][C][=N][C][=N][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C@@H1][Ring1][=C][C][O][N][=Ring2][Ring1][Branch2]
|
c16ncnc2sccc12.[C@H]17CCN6[C@@H]1C.Cc1cc8on1.C8C5=O.N57
|
O=C(C[C@@H]1CC[C@@H]2C[C@H]21)N[C@H]1CN(C(=O)[C@H]2C[C@@H](O)C2)CC2(CCC2)C1
|
O=CC[C@@H]CC[C@@H]C[C@H]36)))))))N[C@H]CNC=O)[C@H]C[C@@H]O)C4)))))CCCCC4)))C6
|
[O][=C][Branch1][N][C][C@@H1][C][C][C@@H1][C][C@H1][Ring1][Ring1][Ring1][=Branch1][N][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][O][C][Ring1][Branch1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][S]
|
[C@H]15CN4CC2(CCC2)C1.[C@@H]17CC[C@@H]2C[C@H]21.[C@H]16C[C@@H](O)C1.O=C3C7.C46=O.N35
|
Cc1cnc(C(=O)N2CC(CC(=O)Nc3cc(I)ccc3C)C2)cn1
|
CccncC=O)NCCCC=O)NcccI)ccc6C))))))))))C4)))))cn6
|
[C][C][=C][N][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][I][=C][C][=C][Ring1][#Branch1][C][C][Ring1][S][C][=N][Ring2][Ring1][Branch2]
|
c16cc(I)ccc1C.Cc1cnc7cn1.N14CC8C1.C8C5=O.C47=O.N56
|
COCCC[C@@H](NC(=O)C1CS(=O)(=O)C1)C(=O)N1CC(=O)NC(C)(C)C1
|
COCCC[C@@H]NC=O)CCS=O)=O)C4))))))C=O)NCC=O)NCC)C)C6
|
[C][O][C][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch2]
|
N13CC(=O)NC(C)(C)C1.C4CC[C@@H]5C3=O.C16CS(=O)(=O)C1.C26=O.CO4.N25
|
CN(CCCC(=O)N1CC(C)(C)[C@@H]1C1CC1)C(=O)C=Cc1ccc[nH]1
|
CNCCCC=O)NCCC)C)[C@@H]4CCC3)))))))))))C=O)C=Ccccc[nH]5
|
[C][N][Branch2][Ring1][=Branch2][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][NH1][Ring1][Branch1]
|
N12CC(C)(C)[C@@H]16.C4CCC2=O.C=5c1ccc[nH]1.C3(=O)C=5.CN34.C16CC1
|
C[C@]1(NC(=O)C=Cc2ccccc2)CCCC[C@@H]1C(=O)NCc1nc(C#N)cs1
|
C[C@]NC=O)C=Ccccccc6))))))))))CCCC[C@@H]6C=O)NCcncC#N))cs5
|
[C][C@][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][C@@H1][Ring1][P][C][=Branch1][C][=O][N][C][C][=N][C][Branch1][Ring1][C][#N][=C][S][Ring1][#Branch1]
|
C[C@]15CCCC[C@@H]17.C=8c1ccccc1.c19nc(C#N)cs1.C3(=O)C=8.C47=O.N35.N46.C69
|
C[C@@]1(CC(=O)N2CC(C3CCN(C(=O)c4cccc(O)c4F)CC3)C2)CCOC1
|
C[C@@]CC=O)NCCCCCNC=O)cccccO)c6F))))))))CC6))))))C4))))))CCOC5
|
[C][C@@][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][F][C][C][Ring1][S][C][Ring2][Ring1][Ring2][C][C][O][C][Ring2][Ring1][N]
|
N15CC(C2CCN6CC2)C1.c17cccc(O)c1F.C[C@@]18CCOC1.C8C5=O.C67=O
|
C[C@@H]1CCCC=C1c1cnc(Cl)c(C(=O)Nc2nc(O)c3nc[nH]c3n2)c1
|
C[C@@H]CCCC=C6ccncCl)cC=O)NcncO)cnc[nH]c5n9)))))))))))c6
|
[C][C@@H1][C][C][C][C][=C][Ring1][=Branch1][C][=C][N][=C][Branch1][C][Cl][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=N][C][Branch1][C][O][=C][N][=C][NH1][C][Ring1][Branch1][=N][Ring1][#Branch2][=C][Ring2][Ring1][Ring2]
|
C[C@@H]1CCCC=C1c1cnc(Cl)c6c1.c15nc(O)c2nc[nH]c2n1.C46=O.N45
|
Cc1ncc(CN(C)C(=O)N2CCC[C@@H](C)c3ccccc32)s1
|
CcnccCNC)C=O)NCCC[C@@H]C)cccccc6%11))))))))))))))s5
|
[C][C][=N][C][=C][Branch2][Ring1][N][C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N][S][Ring2][Ring1][=Branch1]
|
N15CCC[C@@H](C)c2ccccc21.Cc1ncc7s1.N46C.C45=O.C67
|
CN(CCc1ccccc1)C(=O)C(C)(C)NC(=O)[C@@H]1CCN1C(C)(C)C
|
CNCCcccccc6))))))))C=O)CC)C)NC=O)[C@@H]CCN4CC)C)C
|
[C][N][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][N][Ring1][Ring2][C][Branch1][C][C][Branch1][C][C][C]
|
c18ccccc1.C2(=O)C5(C)C.[C@@H]17CCN16.C6(C)(C)C.CN24.C4C8.C37=O.N35
|
CCCCCCO[C@@H](C)C(=O)NCC1(O)CN(C(=O)C[C@@H]2C(=O)NN=C2C)C1
|
CCCCCCO[C@@H]C)C=O)NCCO)CNC=O)C[C@@H]C=O)NN=C5C))))))))C4
|
[C][C][C][C][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][N][Branch1][P][C][=Branch1][C][=O][C][C@@H1][C][=Branch1][C][=O][N][N][=C][Ring1][=Branch1][C][C][Ring1][#C]
|
[C@@H]19C(=O)NN=C1C.CCCCCC5.C18(O)CN4C1.[C@H]6(C)C3=O.C4(=O)C9.O56.N37.C78
|
CCC=CC(=O)N[C@H](CCCC)CC(=O)N1CC(CCCCC)C1
|
CCC=CC=O)N[C@H]CCCC))))CC=O)NCCCCCCC)))))C4
|
[C][C][C][=C][C][=Branch1][C][=O][N][C@H1][Branch1][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][C][C][C][C][C][C][Ring1][=Branch2]
|
[C@@H]4(CCCC)CC3=O.N13CC6C1.C6CCCC.C=5C2=O.CCC=5.N24
|
CC[C@@H]1CCN(C(=O)[C@@H]2CN(C)CCN2C(=O)[C@@H]2CCC[C@@H](C#N)C2)C1
|
CC[C@@H]CCNC=O)[C@@H]CNC)CCN6C=O)[C@@H]CCC[C@@H]C#N))C6))))))))))))))C5
|
[C][C][C@@H1][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@@H1][C][N][Branch1][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][C@@H1][Branch1][Ring1][C][#N][C][Ring1][Branch2][C][Ring2][Ring1][Branch2]
|
[C@@H]15CN(C)CCN14.[C@@H]16CCC[C@@H](C#N)C1.[C@@H]17CCN3C1.C35=O.C46=O.CC7
|
COC1(CCNC(=O)C(C)(C)CC(F)(F)F)CN(C(=O)c2ns[nH]c2=O)C1
|
COCCCNC=O)CC)C)CCF)F)F))))))))CNC=O)cns[nH]c5=O)))))))C4
|
[C][O][C][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][N][Branch1][=N][C][=Branch1][C][=O][C][=N][S][NH1][C][Ring1][Branch1][=O][C][Ring2][Ring1][=Branch2]
|
C3(=O)C(C)(C)CC(F)(F)F.C158CN4C1.c17ns[nH]c1=O.C8C6.C47=O.CO5.N36
|
CC(C)[C@@H](CO)NC(=O)[C@H]1CCCN([C@@H](C)CN2CCN(C)CC2)C1
|
CCC)[C@@H]CO))NC=O)[C@H]CCCN[C@@H]C)CNCCNC)CC6))))))))C6
|
[C][C][Branch1][C][C][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][P][C@@H1][Branch1][C][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring1][S]
|
[C@H]17CCCN5C1.N16CCN(C)CC1.CC(C)[C@H]4CO.[C@H]5(C)C6.C37=O.N34
|
C=C1CCN(C(=O)CN2CC(C)(C)C2)[C@@H](C(=O)N2CC[C@@]3(C=CCO3)C2)C1
|
C=CCCNC=O)CNCCC)C)C4))))))[C@@H]C=O)NCC[C@@]C=CCO5))))C5))))))C6
|
[C][=C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][N][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][C@@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@@][Branch1][#Branch1][C][=C][C][O][Ring1][Branch1][C][Ring1][=Branch2][C][Ring2][Ring1][#Branch2]
|
N15CC[C@@]2(C=CCO2)C1.C=C1CCN4[C@@H]7C1.N16CC(C)(C)C1.C4(=O)C6.C57=O
|
CCON1CCC(CC(=O)N2CCC[C@@]2(C)CNC(=O)c2c(C)ncn2O)CC1
|
CCONCCCCC=O)NCCC[C@@]5C)CNC=O)ccC)ncn5O))))))))))))))))CC6
|
[C][C][O][N][C][C][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][=C][N][Ring1][=Branch1][O][C][C][Ring2][Ring1][#Branch2]
|
O5N1CCC9CC1.N13CCC[C@]18C.c17c(C)ncn1O.C9C3=O.C47=O.CC5.C68.N46
|
C=C(C)CC(=O)NC[C@H]1COCCN1C(=O)C[C@@H](CC)C(=O)OC(C)(C)C
|
C=CC)CC=O)NC[C@H]COCCN6C=O)C[C@@H]CC))C=O)OCC)C)C
|
[C][=C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
C4(=O)C[C@@H](CC)C2=O.[C@H]17COCCN14.C=C(C)CC3=O.C5(C)(C)C.N36.C67.O25
|
CC(C)(C)OC(=O)N[C@H](Cc1ccc(Cl)cc1Cl)C(=O)OCCCC1(C#N)CC1
|
CCC)C)OC=O)N[C@H]CccccCl)cc6Cl))))))))C=O)OCCCCC#N))CC3
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C@H1][Branch1][=C][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][=Branch1][C][=O][O][C][C][C][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch1]
|
c19ccc(Cl)cc1Cl.[C@@H]7(C9)C3=O.C18(C#N)CC1.CC5(C)C.C6CC8.C24=O.O25.N47.O36
|
CCc1n[nH]cc1C(=O)NC[C@@H](CO)CNC(=O)c1cn(C(C)C)cc1C
|
CCcn[nH]cc5C=O)NC[C@@H]CO))CNC=O)ccnCC)C))cc5C
|
[C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][Branch2][C]
|
c17cn8cc1C.c19n[nH]cc16.C4[C@H](C5)CO.C26=O.C37=O.C8(C)C.CC9.N24.N35
|
CCn1ncc(Cl)c1C(=O)N1CC[C@@]2(CCCN2C(=O)[C@H]2C[C@H]2C(=O)OC)C1
|
CCnnccCl)c5C=O)NCC[C@@]CCCN5C=O)[C@H]C[C@H]3C=O)OC)))))))))))C5
|
[C][C][N][N][=C][C][Branch1][C][Cl][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][=Branch1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][O][C][C][Ring2][Ring1][C]
|
N14CC[C@@]2(CCCN25)C1.n19ncc(Cl)c16.[C@H]17C[C@H]18.C46=O.C57=O.C38=O.CC9.O3C
|
CCC[C@@H](C)[C@H](C)NC(=O)c1cc(CNC(=O)c2nccn2CC)[nH]n1
|
CCC[C@@H]C)[C@H]C)NC=O)cccCNC=O)cnccn5CC))))))))))[nH]n5
|
[C][C][C][C@@H1][Branch1][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][S][C][N][C][=Branch1][C][=O][C][=N][C][=C][N][Ring1][Branch1][C][C][NH1][N][=Ring1][S]
|
CCC[C@@H](C)[C@@H]5C.c17cc%10[nH]n1.c18nccn19.C37=O.C48=O.N35.C6%10.N46.C9C
|
Cc1cc(C(=O)NC[C@H](C(=O)NC[C@H](O)[C@H](C)O)C(C)(C)C)ccc1F
|
CcccC=O)NC[C@H]C=O)NC[C@H]O)[C@H]C)O))))))CC)C)C))))))ccc6F
|
[C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][Branch2][F]
|
C4[C@H](C3=O)C(C)(C)C.Cc1cc6ccc1F.C5[C@H](O)[C@H](C)O.C26=O.N24.N35
|
CCC(CC)(CC)C(=O)N1CCC[C@@H]1CNC(=O)[C@H]1CCCC[C@H]1C(N)=O
|
CCCCC))CC))C=O)NCCC[C@@H]5CNC=O)[C@H]CCCC[C@H]6CN)=O
|
[C][C][C][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][Branch1][C][N][=O]
|
CCC(CC)(CC)C2=O.[C@H]15CCCC[C@H]16.N12CCC[C@@H]17.C35=O.C6(N)=O.C47.N34
|
CC[C@@]1(C(=O)NOC)CCCN1C(=O)c1cccc(=O)o1
|
CC[C@@]C=O)NOC))))CCCN5C=O)ccccc=O)o6
|
[C][C][C@@][Branch1][Branch2][C][=Branch1][C][=O][N][O][C][C][C][C][N][Ring1][#Branch2][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][C][=O][O][Ring1][#Branch1]
|
[C@@]135CCCN12.c14cccc(=O)o1.C3(=O)NOC.C24=O.CC5
|
CO[C@@H]1C[C@@H](CNC(=O)CSC(C)C)N(C(=O)c2cnc3scc(C)n23)C1
|
CO[C@@H]C[C@@H]CNC=O)CSCC)C)))))))NC=O)ccncsccC)n85)))))))))C5
|
[C][O][C@@H1][C][C@@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][S][C][Branch1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][N][=C][S][C][=C][Branch1][C][C][N][Ring1][=Branch2][Ring1][=Branch1][C][Ring2][Ring1][=Branch2]
|
c1%10cnc2scc(C)n12.[C@@H]16C[C@@H]%11N5C1.C4(=O)C8.C9(C)C.C5%10=O.CO6.C7%11.N47.S89
|
C[C@@H]1C[C@@H](CNC(=O)CC2(C)OCCO2)CCN1C(=O)[C@@H](C)CSC(F)(F)F
|
C[C@@H]C[C@@H]CNC=O)CCC)OCCO5)))))))))CCN6C=O)[C@@H]C)CSCF)F)F
|
[C][C@@H1][C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][O][C][C][O][Ring1][=Branch1][C][C][N][Ring1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][S][C][Branch1][C][F][Branch1][C][F][F]
|
C[C@@H]1C[C@@H]8CCN14.C17(C)OCCO1.C4(=O)[C@@H](C)C6.S6C(F)(F)F.C3(=O)C7.C58.N35
|
Cc1coc(CNC(=O)C(F)(F)CCn2cc(-c3cnccc3C)nn2)c1
|
CccocCNC=O)CF)F)CCncc-ccnccc6C)))))))nn5)))))))))))c5
|
[C][C][=C][O][C][Branch2][Ring2][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][C][N][C][=C][Branch1][#Branch2][C][=C][N][=C][C][=C][Ring1][=Branch1][C][N][=N][Ring1][N][=C][Ring2][Ring1][#Branch2]
|
C4(=O)C(F)(F)CC6.c18cnccc1C.Cc1coc7c1.n16cc8nn1.C57.N45
|
CCOC(CC(=O)NCCn1cnc(C(=O)Nc2conc2C)c1)OCC
|
CCOCCC=O)NCCncncC=O)Ncconc5C))))))))c5))))))))))OCC
|
[C][C][O][C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][C][N][C][=N][C][Branch1][=C][C][=Branch1][C][=O][N][C][=C][O][N][=C][Ring1][Branch1][C][=C][Ring1][=C][O][C][C]
|
C78CC3=O.n14cnc%12c1.c1%11conc1C.C%10C4.C5%12=O.CC6.O67.N3%10.N5%11.O89.C9C
|
CCCOCC(=O)N1CC[C@@H](C)C[C@H]1CNC(=O)CCOc1ccc(F)c(F)c1
|
CCCOCC=O)NCC[C@@H]C)C[C@H]6CNC=O)CCOccccF)cF)c6
|
[C][C][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2]
|
N12CC[C@@H](C)C[C@H]19.c17ccc(F)c(F)c1.C3(=O)CC6.C5C2=O.CCC4.O45.C89.N38.O67
|
C#CC[C@H](C)C(=O)N1C[C@@H]2CC[C@]2(NC(=O)c2cnnn2C=C)C1
|
C#CC[C@H]C)C=O)NC[C@@H]CC[C@]4NC=O)ccnnn5C=C)))))))))C7
|
[C][#C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][#C][N][C][=Branch1][C][=O][C][=C][N][=N][N][Ring1][Branch1][C][=C][C][Ring1][P]
|
N13C[C@@H]2CC[C@]25C1.C#CC[C@H](C)C3=O.c16cnnn1C=C.C46=O.N45
|
CC(C)C[C@H](CNC(=O)Cc1ccnc(O)c1)C(=O)NCCC(F)=C(F)F
|
CCC)C[C@H]CNC=O)CcccncO)c6))))))))))C=O)NCCCF)=CF)F
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][=C][Branch1][C][F][F]
|
CC(C)C[C@H](C4)C3=O.c16ccnc(O)c1.C5CC(F)=C(F)F.C2(=O)C6.N24.N35
|
C[C@@H]1C[C@@H]1C(=O)N1CC[C@@H]1CNC(=O)c1nc(Br)c2c(F)cccn12
|
C[C@@H]C[C@@H]3C=O)NCC[C@@H]4CNC=O)cncBr)ccF)cccn96
|
[C][C@@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=N][C][Branch1][C][Br][=C][C][Branch1][C][F][=C][C][=C][N][Ring1][O][Ring1][#Branch1]
|
c16nc(Br)c2c(F)cccn12.N13CC[C@@H]18.C[C@@H]1C[C@@H]17.C37=O.C46=O.C58.N45
|
COc1ccc2ncc(C(=O)N3CCN(C(=O)[C@@H]4CC45CC5)C[C@H](O)C3)n2n1
|
COccccnccC=O)NCCNC=O)[C@@H]CC3CC3))))))C[C@H]O)C7))))))))n5n9
|
[C][O][C][C][=C][C][=N][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1][C][C@H1][Branch1][C][O][C][Ring1][#C][N][Ring2][Ring1][=Branch1][N][=Ring2][Ring1][#Branch2]
|
c18ccc2ncc9n2n1.N16CCN7C[C@H](O)C1.[C@@H]1%10CC12CC2.C69=O.C7%10=O.CO8
|
CC(C)[C@@H](CC(=O)N1CC[C@@H](O)C[C@@H]1C1CC1)NC(=O)CCOC1CCCC1
|
CCC)[C@@H]CC=O)NCC[C@@H]O)C[C@@H]6CCC3)))))))))))NC=O)CCOCCCCC5
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][O][C][C@@H1][Ring1][#Branch1][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][O][C][C][C][C][C][Ring1][Branch1]
|
CC(C)[C@H]6CC2=O.N12CC[C@@H](O)C[C@@H]17.C3(=O)CC4.C15CCCC1.C17CC1.N36.O45
|
CC(C)[C@H]1CN(C(=O)C(C)(C)[C@H](C)NC(=O)c2ccsc2C#N)CC(=O)N1
|
CCC)[C@H]CNC=O)CC)C)[C@H]C)NC=O)cccsc5C#N))))))))))))CC=O)N6
|
[C][C][Branch1][C][C][C@H1][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][#N][C][C][=Branch1][C][=O][N][Ring2][Ring1][Branch2]
|
[C@H]17CN3CC(=O)N1.C3(=O)C(C)(C)[C@@H]5C.c16ccsc1C#N.CC7C.C46=O.N45
|
Cc1cc(C(=O)N[C@@H]2CCN(C(=O)Cc3ccccc3Cl)C2)n(C)n1
|
CcccC=O)N[C@@H]CCNC=O)Ccccccc6Cl)))))))))C5)))))))nC)n5
|
[C][C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Ring1][#C][N][Branch1][C][C][N][=Ring2][Ring1][Branch2]
|
Cc1cc7n(C)n1.c18ccccc1Cl.[C@@H]16CCN5C1.C5(=O)C8.C47=O.N46
|
CCC=C(CCC)C(=O)NCCC(C)(C)C(=O)NC[C@H]1OCCC1(C)C
|
CCC=CCCC)))C=O)NCCCC)C)C=O)NC[C@H]OCCC5C)C
|
[C][C][C][=C][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][O][C][C][C][Ring1][Branch1][Branch1][C][C][C]
|
C4CC(C)(C)C3=O.C=6(CCC)C2=O.[C@H]17OCCC1(C)C.CCC=6.N24.N35.C57
|
CCc1nc(C)ncc1C(=O)NCCCCC1(NC(=O)[C@@H]2CCCSC2)CC1
|
CCcncC)ncc6C=O)NCCCCCNC=O)[C@@H]CCCSC6))))))))CC3
|
[C][C][C][=N][C][Branch1][C][C][=N][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][=C][N][C][=Branch1][C][=O][C@@H1][C][C][C][S][C][Ring1][=Branch1][C][C][Ring1][N]
|
c19nc(C)ncc18.[C@@H]17CCCSC1.C5CCC%10.C16%10CC1.C38=O.C47=O.CC9.N35.N46
|
CCOCC(=O)NC[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)c1ccc2c[nH]nc2n1
|
CCOCC=O)NC[C@@H]C[C@H]CC[C@@H]6N5C=O)ccccc[nH]nc5n9
|
[C][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][NH1][N][=C][Ring1][Branch1][N][=Ring1][=Branch2]
|
c18ccc2c[nH]nc2n1.[C@@H]19C[C@H]2CC[C@@H]1N24.C6C3=O.C48=O.CC5.O56.N37.C79
|
CN(C)C1(C(=O)N2CC[C@H](CCC(=O)NCc3ccc(Cl)cc3)C2)CCCC1
|
CNC)CC=O)NCC[C@H]CCC=O)NCccccCl)cc6)))))))))))C5))))))CCCC5
|
[C][N][Branch1][C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Ring2][Ring1][C][C][C][C][C][Ring2][Ring1][=Branch2]
|
c1%10ccc(Cl)cc1.C168CCCC1.N14CC[C@H]9C1.C9CC5=O.CN6C.C48=O.N57.C7%10
|
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