SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
CCC(CC)[C@H](C)C(=O)N[C@@H]1CCCN(c2nccc(CC(=O)OC)n2)[C@@H]1C
|
CCCCC))[C@H]C)C=O)N[C@@H]CCCNcncccCC=O)OC))))n6))))))[C@@H]6C
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch2][Ring1][C][C][=N][C][=C][C][Branch1][Branch2][C][C][=Branch1][C][=O][O][C][=N][Ring1][O][C@@H1][Ring1][P][C]
|
CCC(CC)[C@H](C)C4=O.[C@@H]16CCCN5[C@@H]1C.c15nccc7n1.C7C3=O.N46.O3C
|
CCN(CCCNC(=O)C1(C)CC(C)C1)C(=O)[C@H](OC)C1CCC(F)(F)CC1
|
CCNCCCNC=O)CC)CCC)C4)))))))))C=O)[C@H]OC))CCCCF)F)CC6
|
[C][C][N][Branch2][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][Branch1][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][Branch1][Ring1][O][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2]
|
C19CCC(F)(F)CC1.C18(C)CC(C)C1.C3(=O)[C@H]49.C6CC7.N356.C28=O.CC5.N27.O4C
|
CN(C)Cc1ccc(CCNc2cc(=NC[C@@H]3C[C@H](O)C3(C)C)[nH]cn2)cc1
|
CNC)CccccCCNccc=NC[C@@H]C[C@H]O)C4C)C)))))))[nH]cn6)))))))))cc6
|
[C][N][Branch1][C][C][C][C][=C][C][=C][Branch2][Ring1][=N][C][C][N][C][=C][C][=Branch1][S][=N][C][C@@H1][C][C@H1][Branch1][C][O][C][Ring1][Branch1][Branch1][C][C][C][NH1][C][=N][Ring1][#C][C][=C][Ring2][Ring1][Branch2]
|
c16cc(=NC7)[nH]cn1.c18ccc9cc1.[C@@H]17C[C@H](O)C1(C)C.CN4C.C9C5.C48.N56
|
C=CC1(O)CN(C(=O)C[C@H]2CN(C(=O)C3CCCCCC3)CCO2)C1
|
C=CCO)CNC=O)C[C@H]CNC=O)CCCCCCC7))))))))CCO6))))))))C4
|
[C][=C][C][Branch1][C][O][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][#Branch1][C][C][O][Ring1][#C][C][Ring2][Ring1][#Branch1]
|
C=CC1(O)CN4C1.[C@H]17CN5CCO1.C16CCCCCC1.C4(=O)C7.C56=O
|
Cc1cc(C(=O)NCC[C@@H]2CSCCN2C(=O)C[C@H]2Cc3ccccc3O2)c[nH]1
|
CcccC=O)NCC[C@@H]CSCCN6C=O)C[C@H]Ccccccc6O9)))))))))))))))))))))c[nH]5
|
[C][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][S][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][=C][NH1][Ring2][Ring1][N]
|
[C@H]19Cc2ccccc2O1.[C@@H]18CSCCN15.Cc1cc7c[nH]1.C5(=O)C9.C47=O.C6C8.N46
|
C=CC=CCC(=O)N1CC[C@@H]2CN(C(=O)[C@@H]3CC[C@H]4C[C@@H]3CO4)C[C@@H]2CC1
|
C=CC=CCC=O)NCC[C@@H]CNC=O)[C@@H]CC[C@H]C[C@@H]6CO5)))))))))C[C@@H]5CC%10
|
[C][=C][C][=C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][C@H1][C][C@@H1][Ring1][=Branch1][C][O][Ring1][Branch1][C][C@@H1][Ring1][#C][C][C][Ring2][Ring1][Ring2]
|
N15CC[C@@H]2CN6C[C@@H]2CC1.[C@@H]17CC[C@H]2C[C@@H]1CO2.C=8CC5=O.C=CC=8.C67=O
|
C[C@@]1(C(=O)N[C@H](CO)C2CC2)CCCN1C(=O)c1c(F)cncc1F
|
C[C@@]C=O)N[C@H]CO))CCC3))))))CCCN5C=O)ccF)cncc6F
|
[C][C@@][Branch1][S][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][C][C][Ring1][Ring1][C][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=N][C][=C][Ring1][#Branch1][F]
|
c17c(F)cncc1F.C[C@@]16CCCN14.[C@H]58CO.C36=O.C18CC1.C47=O.N35
|
CC(C)C(CC(=O)NCC1(O)CC(CNC(=O)C[C@H]2CCOC2=O)C1)C(C)C
|
CCC)CCC=O)NCCO)CCCNC=O)C[C@H]CCOC5=O))))))))))C4))))))))CC)C
|
[C][C][Branch1][C][C][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C@H1][C][C][O][C][Ring1][Branch1][=O][C][Ring1][S][C][Branch1][C][C][C]
|
CC(C)C(CC3=O)C(C)C.C17(O)CC8C1.[C@H]19CCOC1=O.C4(=O)C9.N35.C57.C68.N46
|
CC(C)(C)CONC(=O)C[C@@H]1CCCc2ccccc21
|
CCC)C)CONC=O)C[C@@H]CCCcccccc6%10
|
[C][C][Branch1][C][C][Branch1][C][C][C][O][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2]
|
O3NC(=O)C[C@@H]1CCCc2ccccc21.CC(C)(C)C3
|
COc1cccc(C(=O)N[C@@H]2CCN(C(=O)[C@@H](C)CF)C2(C)C)c1F
|
COcccccC=O)N[C@@H]CCNC=O)[C@@H]C)CF))))C5C)C))))))))c6F
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][F][C][Ring1][O][Branch1][C][C][C][=C][Ring2][Ring1][=Branch1][F]
|
c15cccc7c1F.[C@@H]16CCN4C1(C)C.C4(=O)[C@@H](C)CF.C37=O.CO5.N36
|
CC[C@H]1CN(C)CCN1C(=O)[C@H]1CCCN(C(=O)c2nccc(C)c2F)C1
|
CC[C@H]CNC)CCN6C=O)[C@H]CCCNC=O)cncccC)c6F))))))))C6
|
[C][C][C@H1][C][N][Branch1][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][F][C][Ring1][S]
|
[C@H]17CN(C)CCN13.c15nccc(C)c1F.[C@H]16CCCN4C1.C36=O.C45=O.CC7
|
CN(C(=O)C[C@H]1C[C@H]2CC[C@H]1O2)C1CN(C(=O)CCc2ccc(Cl)s2)C1
|
CNC=O)C[C@H]C[C@H]CC[C@H]6O5)))))))))CCNC=O)CCccccCl)s5))))))))C4
|
[C][N][Branch1][P][C][=Branch1][C][=O][C][C@H1][C][C@H1][C][C][C@H1][Ring1][=Branch1][O][Ring1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1][C][Ring1][=C]
|
[C@H]17C[C@H]2CC[C@H]1O2.c16ccc(Cl)s1.C15CN4C1.C4(=O)CC6.C3(=O)C7.CN35
|
C[C@@H](NC(=O)C1(C#N)CC1)C1CCN(C(=O)CN2CCC(F)(F)C2)CC1
|
C[C@@H]NC=O)CC#N))CC3)))))CCCNC=O)CNCCCF)F)C5)))))))CC6
|
[C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][C][Ring1][S]
|
C18CCN4CC1.N16CCC(F)(F)C1.C17(C#N)CC1.C4(=O)C6.C[C@@H]58.C37=O.N35
|
C[C@@H](CNC(=O)CCSc1ccccc1)CN(C)C(=O)c1cnc(C2CC2)o1
|
C[C@@H]CNC=O)CCScccccc6))))))))))))CNC)C=O)ccncCCC3)))o5
|
[C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2]
|
c19ccccc1.c18cnc%10o1.C[C@@H](C5)C6.C3(=O)CC7.N46C.C48=O.C1%10CC1.N35.S79
|
CC(C)(C)C[C@@H](O)CC(=O)N1C[C@@H]2[C@H](C1)[C@H]2C(=O)N1C[C@@H](CO)C1(C)C
|
CCC)C)C[C@@H]O)CC=O)NC[C@@H][C@H]C5)[C@H]3C=O)NC[C@@H]CO))C4C)C
|
[C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][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@@H1][Branch1][Ring1][C][O][C][Ring1][=Branch1][Branch1][C][C][C]
|
CC(C)(C)C[C@@H](O)CC3=O.N13C[C@@H]2[C@@H]5[C@@H]2C1.N14C[C@@H]6C1(C)C.C45=O.C6O
|
CC(C)c1nc(-c2ccnc(Cl)c2Cl)n(-c2ccccc2C(C)C)n1
|
CCC)cnc-cccncCl)c6Cl)))))))n-cccccc6CC)C))))))))n5
|
[C][C][Branch1][C][C][C][N][=C][Branch1][=N][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][N][Branch1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][N][=Ring2][Ring1][=Branch1]
|
c16ccnc(Cl)c1Cl.c13nc6n5n1.c15ccccc14.CC3C.C4(C)C
|
O=C(N[C@@H]1CCCN(C(=O)c2ccc(O)nn2)C1)[C@@H]1CCO[C@H]1c1cccnc1
|
O=CN[C@@H]CCCNC=O)ccccO)nn6)))))))C6)))))))[C@@H]CCO[C@H]5ccccnc6
|
[O][=C][Branch2][Ring1][O][N][C@@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][N][=N][Ring1][#Branch1][C][Ring1][#C][C@@H1][C][C][O][C@H1][Ring1][Branch1][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
[C@@H]15CCCN4C1.c16ccc(O)nn1.[C@@H]17CCO[C@H]18.c18cccnc1.O=C37.C46=O.N35
|
Cn1ncc(Cl)c1CC(=O)N1[C@H]2CC[C@H]1[C@H](CNC(=O)C1(c3ccno3)CC1)C2
|
CnnccCl)c5CC=O)N[C@H]CC[C@H]5[C@H]CNC=O)Ccccno5)))))CC3))))))C6
|
[C][N][N][=C][C][Branch1][C][Cl][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][C][=C][C][=N][O][Ring1][Branch1][C][C][Ring1][Branch2][C][Ring2][Ring1][C]
|
N14[C@H]2CC[C@H]1[C@H]9C2.Cn1ncc(Cl)c18.c1%10ccno1.C8C4=O.C17%10CC1.C57=O.C69.N56
|
CCCn1nc(C)cc1-c1nc(C(=O)Nc2ccc3nccn3c2)c(C)s1
|
CCCnncC)cc5-cncC=O)Nccccnccn5c9)))))))))))cC)s5
|
[C][C][C][N][N][=C][Branch1][C][C][C][=C][Ring1][=Branch1][C][=N][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=N][C][=C][N][Ring1][Branch1][C][=Ring1][=Branch2][=C][Branch1][C][C][S][Ring2][Ring1][C]
|
c15ccc2nccn2c1.n17nc(C)cc18.c18nc6c(C)s1.CCC7.C46=O.N45
|
CCCCC[C@@H](C)NC(=O)C[C@H](CC1CC1)NC(=O)CNC(=O)CC
|
CCCCC[C@@H]C)NC=O)C[C@H]CCCC3))))NC=O)CNC=O)CC
|
[C][C][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C]
|
CCCCC[C@H]5C.C2(=O)C[C@@H]6C8.C3(=O)C7.C4(=O)CC.C18CC1.N25.N36.N47
|
O=C(C[C@@H]1Cc2ccccc2O1)NCc1ccnc(OCc2ccccc2)c1
|
O=CC[C@@H]Ccccccc6O9))))))))))NCcccncOCcccccc6))))))))c6
|
[O][=C][Branch1][#C][C][C@@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][N][C][C][=C][C][=N][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=C]
|
[C@@H]17Cc2ccccc2O1.c18ccnc5c1.c19ccccc1.O=C3C7.N36.C68.O45.C49
|
CCn1cc(Cl)cc1C(=O)NC[C@@]1(C)CCCN1C(=O)c1cc(C(F)(F)F)cs1
|
CCnccCl)cc5C=O)NC[C@@]C)CCCN5C=O)cccCF)F)F))cs5
|
[C][C][N][C][=C][Branch1][C][Cl][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][S][Ring1][=Branch2]
|
n17cc(Cl)cc15.[C@]18(C)CCCN13.c16cc9cs1.C9(F)(F)F.C25=O.C36=O.CC7.N24.C48
|
Cc1nncc(C(=O)N2CCC[C@](F)(C(=O)N[C@H]3CC[C@H](O)CC3)C2)c1C
|
CcnnccC=O)NCCC[C@]F)C=O)N[C@H]CC[C@H]O)CC6))))))))C6)))))))c6C
|
[C][C][=N][N][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][F][Branch1][P][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch1][C][O][C][C][Ring1][#Branch1][C][Ring1][P][=C][Ring2][Ring1][=Branch2][C]
|
Cc1nncc8c1C.N14CCC[C@@]7(F)C1.[C@H]16CC[C@H](O)CC1.C48=O.C57=O.N56
|
C[C@@H](C(=O)N1CC(NC(=O)[C@@H]2C[C@H]2C(C)(C)O)C1)c1ccc(Br)c(F)c1
|
C[C@@H]C=O)NCCNC=O)[C@@H]C[C@H]3CC)C)O)))))))C4)))))ccccBr)cF)c6
|
[C][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][=C][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][F][=C][Ring1][Branch2]
|
c18ccc(Br)c(F)c1.C[C@H]8C3=O.N13CC5C1.[C@@H]16C[C@H]17.C7(C)(C)O.C46=O.N45
|
Cc1noc(C(=O)N2CCC(C(C)(C)CNC(=O)[C@H]3CCC[C@@H](F)C3)CC2)n1
|
CcnocC=O)NCCCCC)C)CNC=O)[C@H]CCC[C@@H]F)C6))))))))))CC6)))))))n5
|
[C][C][=N][O][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][C][F][C][Ring1][#Branch1][C][C][Ring2][Ring1][Ring2][=N][Ring2][Ring1][O]
|
N14CCC9CC1.[C@H]18CCC[C@@H](F)C1.Cc1noc7n1.C9(C)(C)C6.C47=O.C58=O.N56
|
Cc1cc(F)c(C(=O)NCCN(C)C(=O)c2cnc3c(N)cccc3c2)cc1F
|
CcccF)cC=O)NCCNC)C=O)ccnccN)cccc6c%10))))))))))))))))cc6F
|
[C][C][=C][C][Branch1][C][F][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][N][=C][C][=C][C][Ring1][#Branch1][=C][Ring1][O][C][=C][Ring2][Ring1][O][F]
|
c19cnc2c(N)cccc2c1.Cc1cc(F)c8cc1F.C48=O.C6C7.N57C.C59=O.N46
|
CC1(C)CCC(C(=O)N[C@@H]2CCN(C(=O)c3cc(O)cc(C#N)c3)C[C@@H]2F)CC1
|
CCC)CCCC=O)N[C@@H]CCNC=O)cccO)ccC#N))c6)))))))C[C@@H]6F)))))))))CC6
|
[C][C][Branch1][C][C][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][Branch1][Ring1][C][#N][=C][Ring1][=Branch2][C][C@@H1][Ring1][P][F][C][C][Ring2][Ring1][N]
|
c18cc(O)cc(C#N)c1.CC1(C)CCC7CC1.[C@@H]16CCN5C[C@@H]1F.C47=O.C58=O.N46
|
Cc1ccncc1C(=O)N1[C@H](C)C[C@H]1C(=O)NC[C@@H]1Cc2nccn2C1
|
Ccccncc6C=O)N[C@H]C)C[C@H]4C=O)NC[C@@H]Ccnccn5C8
|
[C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][=N][C][=C][N][Ring1][Branch1][C][Ring1][Branch2]
|
[C@@H]18Cc2nccn2C1.Cc1ccncc17.N13[C@H]6C[C@H]1C.C37=O.C46=O.N45.C58
|
CN1CCC(C(=O)N[C@@H]2CN(C(=O)C3(F)CCCCC3)C[C@H]2C2CC2)CC1
|
CNCCCC=O)N[C@@H]CNC=O)CF)CCCCC6)))))))C[C@H]5CCC3))))))))))CC6
|
[C][N][C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][F][C][C][C][C][C][Ring1][#Branch1][C][C@H1][Ring1][=C][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][#Branch2]
|
[C@@H]16CN5C[C@H]1C1CC1.CN1CCC7CC1.C18(F)CCCCC1.C47=O.C58=O.N46
|
O=C(NC[C@]1(O)CCN(C(=O)C[C@H]2CCC(F)(F)C2)C1)c1n[nH]cc1F
|
O=CNC[C@]O)CCNC=O)C[C@H]CCCF)F)C5)))))))C5)))))))cn[nH]cc5F
|
[O][=C][Branch2][Ring2][C][N][C][C@][Branch1][C][O][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][Ring1][S][C][=N][NH1][C][=C][Ring1][Branch1][F]
|
[C@@]17(O)CCN4C1.[C@H]18CCC(F)(F)C1.c16n[nH]cc1F.C4(=O)C8.O=C36.N35.C57
|
Cc1nc(F)ccc1NC(=O)[C@H]1CCC[C@@H](N)C1
|
CcncF)ccc6NC=O)[C@H]CCC[C@@H]N)C6
|
[C][C][=N][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][C][N][C][Ring1][#Branch1]
|
Cc1nc(F)ccc13.[C@H]14CCC[C@@H](N)C1.C24=O.N23
|
COC[C@H](C)CC(=O)N1C[C@H](NC(=O)c2cccc3c2CCC3)[C@@H](SC)C1
|
COC[C@H]C)CC=O)NC[C@H]NC=O)cccccc6CCC5)))))))))))[C@@H]SC))C5
|
[C][O][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Branch1][C@@H1][Branch1][Ring1][S][C][C][Ring2][Ring1][Ring1]
|
c18cccc2c1CCC2.C6[C@H](C)CC4=O.N14C[C@H]7[C@@H]9C1.C58=O.CO6.N57.S9C
|
O=C(Cc1ccnc(O)c1)NCCc1n[nH]cc1C(=O)N1CC(n2cnnc2)C1
|
O=CCcccncO)c6)))))))NCCcn[nH]cc5C=O)NCCncnnc5)))))C4
|
[O][=C][Branch1][=N][C][C][=C][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][N][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][N][C][=N][N][=C][Ring1][Branch1][C][Ring1][=Branch2]
|
c18ccnc(O)c1.c17n[nH]cc16.N14CC9C1.n19cnnc1.O=C3C8.C5C7.C46=O.N35
|
CC[C@@H](O)CCCN=c1[nH]c2ccc(S(=O)(=O)N3C[C@H](C)C[C@H](C)C3)cc2s1
|
CC[C@@H]O)CCCN=c[nH]ccccS=O)=O)NC[C@H]C)C[C@H]C)C6)))))))cc6s9
|
[C][C][C@@H1][Branch1][C][O][C][C][C][N][=C][NH1][C][=C][C][=C][Branch2][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][C][Ring1][Branch2][C][=C][Ring1][P][S][Ring2][Ring1][Ring2]
|
CC[C@@H](O)CCCN=c1[nH]c2ccc(S4(=O)=O)cc2s1.N14C[C@H](C)C[C@H](C)C1
|
CCCCC1(NC(=O)c2ccoc2CNC(=O)[C@]23CCC[C@H]2C3(F)F)CC1
|
CCCCCNC=O)cccoc5CNC=O)[C@]CCC[C@H]5C6F)F)))))))))))))))))CC3
|
[C][C][C][C][C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][C][N][C][=Branch1][C][=O][C@][C][C][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][Branch1][C][F][F][C][C][Ring2][Ring1][#Branch1]
|
[C@]128CCC[C@H]1C2(F)F.c19ccoc1%10.CCCC%11.C16%11CC1.C49=O.C58=O.N46.C7%10.N57
|
CSCC(=O)NC[C@@]12C[C@@H](CO1)N(c1cncc(Cl)n1)C2
|
CSCC=O)NC[C@@]C[C@@H]CO5))NccnccCl)n6))))))C5
|
[C][S][C][C][=Branch1][C][=O][N][C][C@@][C][C@@H1][Branch1][Branch1][C][O][Ring1][Branch1][N][Branch1][N][C][=C][N][=C][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][Ring1][=C]
|
[C@@]127C[C@@H](CO1)N6C2.c16cncc(Cl)n1.C5C3=O.CS5.N34.C47
|
Cn1nc(C(=O)N2C[C@@H]3CCC[C@]3(NC(=O)[C@@H](O)P(C)(C)=O)C2)cc1C(F)(F)F
|
CnncC=O)NC[C@@H]CCC[C@]5NC=O)[C@@H]O)PC)C)=O)))))C8)))))))))cc5CF)F)F
|
[C][N][N][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@][Ring1][Branch1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][P][Branch1][C][C][Branch1][C][C][=O][C][Ring1][P][C][=C][Ring2][Ring1][Branch2][C][Branch1][C][F][Branch1][C][F][F]
|
N14C[C@@H]2CCC[C@]26C1.C5(=O)[C@@H](O)P(C)(C)=O.Cn1nc7cc18.C8(F)(F)F.C47=O.N56
|
CCCCS(=O)(=O)CC(=O)N[C@H]1C[C@H](F)CN(C(=O)c2ccc3cnnn3c2)C1
|
CCCCS=O)=O)CC=O)N[C@H]C[C@H]F)CNC=O)cccccnnn5c9))))))))))C6
|
[C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][C][F][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][C][=C][N][=N][N][Ring1][Branch1][C][=Ring1][=Branch2][C][Ring2][Ring1][C]
|
CCCCS(=O)(=O)CC4=O.c17ccc2cnnn2c1.[C@H]16C[C@H](F)CN5C1.C57=O.N46
|
O=C(CC1CC=CC1)NC[C@@H]1CN(C(=O)C=Cc2ncc[nH]2)CC[C@]12CCOC2
|
O=CCCCC=CC5))))))NC[C@@H]CNC=O)C=Ccncc[nH]5))))))))CC[C@]6CCOC5
|
[O][=C][Branch1][=Branch2][C][C][C][C][=C][C][Ring1][Branch1][N][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=N][C][=C][NH1][Ring1][Branch1][C][C][C@][Ring1][#C][C][C][O][C][Ring1][Branch1]
|
[C@@H]18CN4CC[C@]12CCOC2.C=6c1ncc[nH]1.C17CC=CC1.O=C3C7.C4(=O)C=6.N35.C58
|
CCOc1ccccc1NC(=O)c1coc([C@H](C)NC(=O)c2cscc2OC)n1
|
CCOcccccc6NC=O)ccoc[C@H]C)NC=O)ccscc5OC))))))))))n5
|
[C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][O][C][Branch2][Ring1][Ring1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][O][C][=N][Ring1][P]
|
c17ccccc1%10.c1%11coc4n1.c1%12cscc18.C3%11=O.[C@@H]94C.C5%12=O.CC6.O67.N3%10.N59.O8C
|
COC1(CC(=O)N[C@H]2CCN(C(=O)c3cc(O)ccc3F)C2)CCC1
|
COCCC=O)N[C@H]CCNC=O)cccO)ccc6F))))))))C5))))))))CCC4
|
[C][O][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][F][C][Ring1][#C][C][C][C][Ring2][Ring1][#Branch1]
|
c18cc(O)ccc1F.[C@H]17CCN5C1.C169CCC1.C9C4=O.C58=O.CO6.N47
|
CC(=O)C[C@@H](C)NC(=O)c1ccc(Cl)cc1C(F)F
|
CC=O)C[C@@H]C)NC=O)ccccCl)cc6CF)F
|
[C][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Branch1][C][F][F]
|
c14ccc(Cl)cc15.CC(=O)C[C@H]3C.C24=O.C5(F)F.N23
|
Cc1cc(Cl)ccc1CN1CCC[C@@](C)(C(=O)N[C@@H](C)c2cncnc2)C1
|
CcccCl)ccc6CNCCC[C@@]C)C=O)N[C@@H]C)ccncnc6)))))))))C6
|
[C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][N][C][C][C][C@@][Branch1][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=C][N][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
Cc1cc(Cl)ccc17.N14CCC[C@]6(C)C1.c18cncnc1.C36=O.[C@@H]58C.C47.N35
|
O=C(Cc1cccs1)NC[C@@H]1COCCN1C(=O)C=Cc1ccc(Br)cc1
|
O=CCccccs5))))))NC[C@@H]COCCN6C=O)C=CccccBr)cc6
|
[O][=C][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][N][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1]
|
C=5c1ccc(Br)cc1.[C@@H]16COCCN13.c17cccs1.O=C2C7.C3(=O)C=5.N24.C46
|
CC[C@@H]1CCCC[C@@H]1C(=O)N1CCCC12CCN(C(=O)/C=C/CN(C)C)CC2
|
CC[C@@H]CCCC[C@@H]6C=O)NCCCC5CCNC=O)/C=C/CNC)C))))))CC6
|
[C][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][/C][=C][/C][N][Branch1][C][C][C][C][C][Ring1][=C]
|
N13CCCC12CCN4CC2.[C@@H]18CCCC[C@@H]16.C4(=O)C=7.C36=O.C=7C5.N5(C)C.CC8
|
CCC[C@H](CC)C(=O)N[C@H]1C[C@H](NC(=O)C2CCOCC2)[C@@H](O)C1
|
CCC[C@H]CC))C=O)N[C@H]C[C@H]NC=O)CCCOCC6))))))))[C@@H]O)C5
|
[C][C][C][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][O][C][C][Ring1][=Branch1][C@@H1][Branch1][C][O][C][Ring1][#C]
|
CCC[C@H](CC)C3=O.[C@H]15C[C@H]6[C@@H](O)C1.C17CCOCC1.C47=O.N35.N46
|
C[C@@H](CCNC(=O)CNS(=O)(=O)C1CC1)CCNC(=O)CN1C[C@@H]2C[C@H]2C1
|
C[C@@H]CCNC=O)CNS=O)=O)CCC3))))))))))CCNC=O)CNC[C@@H]C[C@H]3C6
|
[C][C@@H1][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][N][C][C@@H1][C][C@H1][Ring1][Ring1][C][Ring1][=Branch1]
|
C[C@@H](CC5)CC7.S9(=O)(=O)C1CC1.N18C[C@@H]2C[C@H]2C1.C3(=O)C6.C4(=O)C8.N35.N69.N47
|
Cc1cccc(-c2nc(NC(=O)C3Cc4cscc4C3)n[nH]2)c1[N+](=O)[O-]
|
Cccccc-cncNC=O)CCccscc5C8))))))))))n[nH]5)))))c6[N+]=O)[O-]
|
[C][C][=C][C][=C][C][Branch2][Ring1][N][C][=N][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=C][Ring1][Branch1][C][Ring1][Branch2][=N][NH1][Ring1][S][=C][Ring2][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1]
|
Cc1cccc8c1[N+](=O)[O-].C17Cc2cscc2C1.c18nc6n[nH]1.C57=O.N56
|
CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@](C)(NC(=O)C=CSc1nc[nH]n1)C1CC1
|
CCS=O)=O)N[C@H]C)C=O)NC[C@@]C)NC=O)C=CScnc[nH]n5))))))))))CCC3
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][S][C][N][=C][NH1][N][=Ring1][Branch1][C][C][C][Ring1][Ring1]
|
C3(=O)C=CS9.CCS7(=O)=O.[C@@H]4(C)C2=O.C5[C@@]68C.c19nc[nH]n1.C18CC1.N47.N25.N36
|
C/C=C/C[C@H](C)C(=O)NC[C@@H](CNC(=O)c1[nH]ncc1C#N)OC
|
C/C=C/C[C@H]C)C=O)NC[C@@H]CNC=O)c[nH]ncc5C#N))))))))))OC
|
[C][/C][=C][/C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][NH1][N][=C][C][=Ring1][Branch1][C][#N][O][C]
|
C=8C[C@H](C)C2=O.c17[nH]ncc1C#N.C5[C@H]4C6.C37=O.CC=8.N25.N36.O4C
|
[N-]=[N+]=N[C@@H]1C[C@@]2(C(=O)N3CC[C@@H](NC(=O)c4c(Cl)cncc4Cl)C3)C[C@@H]12
|
[N-]=[N+]=N[C@@H]C[C@@]C=O)NCC[C@@H]NC=O)ccCl)cncc6Cl)))))))))C5))))))C[C@@H]53
|
[N-1][=N+1][=N][C@@H1][C][C@@][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=N][C][=C][Ring1][#Branch1][Cl][C][Ring1][S][C][C@@H1][Ring2][Ring1][#Branch1][Ring2][Ring1][Branch1]
|
[N-]=[N+]=N[C@@H]1C[C@@]28C[C@@H]12.c19c(Cl)cncc1Cl.N15CC[C@@H]7C1.C58=O.C69=O.N67
|
Cn1nccc1C(=O)N[C@H](CNC(=O)c1c[nH]nc1[C@@H]1CCCO1)C1CC1
|
Cnnccc5C=O)N[C@H]CNC=O)cc[nH]nc5[C@@H]CCCO5)))))))))))))CCC3
|
[C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C@@H1][C][C][C][O][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
Cn1nccc16.c17c[nH]nc19.[C@@H]19CCCO1.[C@H]48C5.C26=O.C37=O.C18CC1.N24.N35
|
C#Cc1ccc(C(=O)N2CC(CO)(NC(=O)C[C@](C)(O)CCC)C2)cc1
|
C#CccccC=O)NCCCO))NC=O)C[C@]C)O)CCC)))))))C4)))))cc6
|
[C][#C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][O][Branch1][P][N][C][=Branch1][C][=O][C][C@][Branch1][C][C][Branch1][C][O][C][C][C][C][Ring1][S][C][=C][Ring2][Ring1][Branch2]
|
C4(=O)C[C@](C)(O)CCC.C#Cc1ccc6cc1.N13CC57C1.C36=O.C7O.N45
|
CCCC[C@@H](CNC(=O)[C@H]1C[C@H]1F)NC(=O)[C@H](C)C(C)(C)C
|
CCCC[C@@H]CNC=O)[C@H]C[C@H]3F)))))))NC=O)[C@H]C)CC)C)C
|
[C][C][C][C][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][F][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C]
|
C3(=O)[C@H](C)C(C)(C)C.CCCC[C@H]4C5.[C@H]16C[C@H]1F.C26=O.N25.N34
|
CCC[C@H](CNC(=O)c1cscc1OC)C(=O)N(C1CC1)[C@@H]1CCO[C@@H]1C
|
CCC[C@H]CNC=O)ccscc5OC))))))))))C=O)NCCC3)))[C@@H]CCO[C@@H]5C
|
[C][C][C][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][O][C][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@@H1][C][C][O][C@@H1][Ring1][Branch1][C]
|
CCC[C@H](C5)C3=O.c18cscc14.[C@@H]17CCO[C@@H]1C.C28=O.N367.C16CC1.N25.O4C
|
CC1(C)COCC[C@@H]1C(=O)N[C@@H](C(=O)N[C@H]1CCCSCC1)c1cccnc1
|
CCC)COCC[C@@H]6C=O)N[C@@H]C=O)N[C@H]CCCSCC7)))))))))ccccnc6
|
[C][C][Branch1][C][C][C][O][C][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C][S][C][C][Ring1][#Branch1][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
CC1(C)COCC[C@@H]16.[C@H]15CCCSCC1.c17cccnc1.[C@@H]47C3=O.C26=O.N24.N35
|
O=C(O)c1ccc(CN2CC[C@@H](CNC(=O)[C@@H]3CC3(F)F)C2)cc1
|
O=CO)ccccCNCC[C@@H]CNC=O)[C@@H]CC3F)F)))))))C5))))))cc6
|
[O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F][C][Ring1][=C][C][=C][Ring2][Ring1][Branch1]
|
c18ccc%10cc1.N15CC[C@@H]9C1.[C@@H]17CC1(F)F.O=C8O.C47=O.C5%10.C69.N46
|
CN(C(=O)Cc1nnc(S)n1C)[C@H]1CCC[C@H](NC(=O)Cc2ccccc2F)C1
|
CNC=O)CcnncS)n5C))))))))[C@H]CCC[C@H]NC=O)Ccccccc6F))))))))))C6
|
[C][N][Branch1][P][C][=Branch1][C][=O][C][C][=N][N][=C][Branch1][C][S][N][Ring1][=Branch1][C][C@H1][C][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][Ring1][P]
|
c17nnc(S)n1C.[C@H]15CCC[C@H]6C1.c18ccccc1F.C3(=O)C7.C4(=O)C8.CN35.N46
|
CNc1cnc(Cl)cc1C(=O)NCC#CCNC(=O)Cc1c(C)nc(O)nc1C
|
CNccncCl)cc6C=O)NCC#CCNC=O)CccC)ncO)nc6C
|
[C][N][C][=C][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][#C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][N][=C][Branch1][C][O][N][=C][Ring1][Branch2][C]
|
c18c(C)nc(O)nc1C.c16cnc(Cl)cc17.C4C#CC5.C3(=O)C8.C27=O.CN6.N24.N35
|
COCCCn1nnnc1[C@H](N[C@H]1CCCCC[C@H]1CO)c1c(C)sc(C)c1Br
|
COCCCnnnnc5[C@H]N[C@H]CCCCC[C@H]7CO))))))))))ccC)scC)c5Br
|
[C][O][C][C][C][N][N][=N][N][=C][Ring1][Branch1][C@H1][Branch1][=N][N][C@H1][C][C][C][C][C][C@H1][Ring1][#Branch1][C][O][C][=C][Branch1][C][C][S][C][Branch1][C][C][=C][Ring1][#Branch1][Br]
|
[C@H]14CCCCC[C@H]17.c18c(C)sc(C)c1Br.n15nnnc16.C2CC5.[C@H]368.CO2.N34.C7O
|
O=C(NCc1nc(CNC(=O)[C@H]2C[C@H]2F)cs1)c1cc2cccnc2s1
|
O=CNCcncCNC=O)[C@H]C[C@H]3F)))))))cs5)))))))ccccccnc6s9
|
[O][=C][Branch2][Ring1][Branch2][N][C][C][=N][C][Branch1][=N][C][N][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][F][=C][S][Ring1][=N][C][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][S][Ring1][=Branch2]
|
c17cc2cccnc2s1.c19nc%10cs1.[C@H]18C[C@H]1F.O=C37.C48=O.N35.C59.C6%10.N46
|
CC(C)(CN1CCN(C(=O)CCCCC#N)CC1)NC(=O)Cc1ccns1
|
CCC)CNCCNC=O)CCCCC#N)))))))CC6)))))))NC=O)Ccccns5
|
[C][C][Branch1][C][C][Branch2][Ring1][=Branch1][C][N][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][C][C][C][#N][C][C][Ring1][=C][N][C][=Branch1][C][=O][C][C][=C][C][=N][S][Ring1][Branch1]
|
C2(=O)CCCCC#N.N15CCN2CC1.CC4(C)C5.c16ccns1.C3(=O)C6.N34
|
N#Cc1oc2ccccc2c1NC(=O)[C@H]1C[C@H]1C(=O)Nc1ccnn2ccnc12
|
N#Ccocccccc6c9NC=O)[C@H]C[C@H]3C=O)Ncccnnccnc95
|
[N][#C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][N][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][=N][N][C][=C][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
N#Cc1oc2ccccc2c15.c16ccnn2ccnc12.[C@H]17C[C@H]18.C37=O.C48=O.N35.N46
|
CCc1ccc(C(=O)N(C)C[C@H]2COCCN2C(=O)[C@H](O)C2CC2)cc1
|
CCccccC=O)NC)C[C@H]COCCN6C=O)[C@H]O)CCC3))))))))))))))cc6
|
[C][C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring1][Branch2]
|
c19ccc6cc1.[C@H]17COCCN14.C4(=O)[C@@H]8O.C36=O.N35C.C18CC1.CC9.C57
|
CC(C)Cc1nnc(N2[C@H](CNC(=O)C[C@H]3CCCC[C@@H]3O)C[C@@H]3COC[C@@H]32)s1
|
CCC)CcnncN[C@H]CNC=O)C[C@H]CCCC[C@@H]6O)))))))))))C[C@@H]COC[C@@H]58))))))))s5
|
[C][C][Branch1][C][C][C][C][=N][N][=C][Branch2][Ring1][S][N][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][O][C][C@@H1][C][O][C][C@@H1][Ring1][Branch1][Ring2][Ring1][Ring2][S][Ring2][Ring1][=Branch2]
|
N16[C@H]7C[C@@H]2COC[C@@H]21.[C@H]19CCCC[C@@H]1O.c18nnc6s1.CC(C)C8.C4(=O)C9.C57.N45
|
CO[C@H](C)CCC(=O)N[C@H](C)C1(CNC(=O)CCCCN2CCCCC2)CC1
|
CO[C@H]C)CCC=O)N[C@H]C)CCNC=O)CCCCNCCCCC6)))))))))))))CC3
|
[C][O][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][P]
|
[C@@H]5(C)CCC3=O.C4(=O)CCCC8.N18CCCCC1.C19%10CC1.[C@H]69C.CO5.N36.C7%10.N47
|
O=C(Cn1cncn1)NCCN(C(=O)C(F)(F)c1ccccn1)C1CC1
|
O=CCncncn5))))))NCCNC=O)CF)F)cccccn6))))))))CCC3
|
[O][=C][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
C3(=O)C8(F)F.c18ccccn1.n17cncn1.O=C2C7.C4C5.N356.C16CC1.N24
|
CON=CC(=O)N(CC(=O)NC1(C)CSC1)C1CCC1
|
CON=CC=O)NCC=O)NCC)CSC4)))))))CCCC4
|
[C][O][N][=C][C][=Branch1][C][=O][N][Branch1][S][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][S][C][Ring1][Branch1][C][C][C][C][Ring1][Ring2]
|
CON=CC2=O.C15(C)CSC1.C4C3=O.C16CCC1.N246.N35
|
CC(C)(C(=O)N1CCCNC(=O)C1)[C@H]1CCCN(C(=O)C[C@H]2CCCNC2=O)C1
|
CCC)C=O)NCCCNC=O)C7))))))))[C@H]CCCNC=O)C[C@H]CCCNC6=O)))))))))C6
|
[C][C][Branch1][C][C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][Ring1][Branch2][C@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@H1][C][C][C][N][C][Ring1][=Branch1][=O][C][Ring1][S]
|
N13CCCNC(=O)C1.[C@H]15CCCN4C1.[C@H]16CCCNC1=O.CC5(C)C3=O.C4(=O)C6
|
C[C@@H](C(=O)N[C@H](CCN(C)C)C(=O)N1CC2(CSC2)C1)C1CCC1
|
C[C@@H]C=O)N[C@H]CCNC)C))))C=O)NCCCSC4)))C4))))))))CCCC4
|
[C][C@@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][C][S][C][Ring1][Ring2][C][Ring1][#Branch1][C][C][C][C][Ring1][Ring2]
|
[C@@H]5(CC6)C4=O.N14CC2(CSC2)C1.C[C@H]7C3=O.C17CCC1.N6(C)C.N35
|
O=C(c1ccc(Cl)o1)N1CC[C@@H](N2CCN(C(=O)[C@@H](O)CN3CCCC3)CC2)C1
|
O=CccccCl)o5)))))NCC[C@@H]NCCNC=O)[C@@H]O)CNCCCC5))))))))CC6))))))C5
|
[O][=C][Branch1][O][C][=C][C][=C][Branch1][C][Cl][O][Ring1][=Branch1][N][C][C][C@@H1][Branch2][Ring1][O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][N][C][C][C][C][Ring1][Branch1][C][C][Ring1][S][C][Ring2][Ring1][Branch1]
|
N17CCN5CC1.c18ccc(Cl)o1.N14CC[C@@H]7C1.C5(=O)[C@@H](O)C6.N16CCCC1.O=C48
|
Cc1cc2[nH]c(C(=O)N[C@H]3C[C@@H](NC(=O)c4sc5nnc(S)n5c4C)C3)cc2s1
|
Cccc[nH]cC=O)N[C@H]C[C@@H]NC=O)cscnncS)n5c8C)))))))))))C4))))))cc5s8
|
[C][C][=C][C][NH1][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][C][S][N][Ring1][=Branch1][C][=Ring1][=Branch2][C][C][Ring1][P][=C][C][=Ring2][Ring1][=Branch2][S][Ring2][Ring1][N]
|
c1%11sc2nnc(S)n2c1C.Cc1cc2[nH]c%10cc2s1.[C@H]18C[C@@H]9C1.C6%10=O.C7%11=O.N68.N79
|
CC(C)(C)C[C@H]1CCCN1C(=O)C1(F)CCN(C(=O)C[C@@H]2CCSC2)CC1
|
CCC)C)C[C@H]CCCN5C=O)CF)CCNC=O)C[C@@H]CCSC5)))))))CC6
|
[C][C][Branch1][C][C][Branch1][C][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][F][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C@@H1][C][C][S][C][Ring1][Branch1][C][C][Ring1][#C]
|
C15(F)CCN4CC1.[C@H]16CCCN13.CC(C)(C)C6.[C@@H]17CCSC1.C4(=O)C7.C35=O
|
CCC[C@H](F)C(=O)N1CC2(CC(CNC(=O)C[C@@]34CCC[C@H]3C4)C2)C1
|
CCC[C@H]F)C=O)NCCCCCNC=O)C[C@@]CCC[C@H]5C6))))))))))C4)))C4
|
[C][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch2][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C@@][C][C][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][#C][C][Ring2][Ring1][C]
|
N15CC2(CC8C2)C1.CCC[C@H](F)C5=O.[C@@]129CCC[C@H]1C2.C6(=O)C9.C78.N67
|
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)N1CC[C@H](NC(=O)C(F)=CC2CC2)[C@@H]1C
|
CCC)[C@@H]CC[C@@H]C)C[C@H]6C=O)NCC[C@H]NC=O)CF)=CCCC3)))))))[C@@H]5C
|
[C][C][Branch1][C][C][C@@H1][C][C][C@@H1][Branch1][C][C][C][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][Branch1][C][F][=C][C][C][C][Ring1][Ring1][C@@H1][Ring1][=C][C]
|
[C@@H]18CC[C@@H](C)C[C@H]16.N13CC[C@H]5[C@@H]1C.C4(=O)C=7F.C=7C1CC1.CC8C.C36=O.N45
|
O=C(Cc1ccnnc1O)N1CCCC[C@@H]1CNC(=O)C12CCC(F)(CC1)CC2
|
O=CCcccnnc6O))))))))NCCCC[C@@H]6CNC=O)CCCCF)CC6))CC6
|
[O][=C][Branch1][O][C][C][=C][C][=N][N][=C][Ring1][=Branch1][O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][Branch1][C][C][Ring1][#Branch1][C][C][Ring1][=Branch2]
|
C126CCC(F)(CC1)CC2.c18ccnnc1O.N13CCCC[C@@H]17.O=C3C8.C46=O.C57.N45
|
O=C(C1CCOCC1)N1CCN(C(=O)c2cn([C@H]3CCOC3)nn2)[C@H](CCO)C1
|
O=CCCCOCC6))))))NCCNC=O)ccn[C@H]CCOC5)))))nn5))))))[C@H]CCO)))C6
|
[O][=C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][N][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][Branch1][Branch2][C@H1][C][C][O][C][Ring1][Branch1][N][=N][Ring1][#Branch2][C@H1][Branch1][Ring2][C][C][O][C][Ring2][Ring1][Branch1]
|
N14CCN5[C@H]8C1.C17CCOCC1.c16cn9nn1.[C@H]19CCOC1.O=C47.C56=O.C8CO
|
CCN=c1[nH]c(C(=O)N2CCC[C@H](C3(NC(=O)c4nc(Cl)sc4C)CC3)C2)cs1
|
CCN=c[nH]cC=O)NCCC[C@H]CNC=O)cncCl)sc5C))))))))CC3)))C6)))))))cs5
|
[C][C][N][=C][NH1][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Branch2][C][Branch1][P][N][C][=Branch1][C][=O][C][N][=C][Branch1][C][Cl][S][C][=Ring1][=Branch1][C][C][C][Ring1][=N][C][Ring2][Ring1][Ring1][=C][S][Ring2][Ring1][#Branch2]
|
N15CCC[C@H](C27CC2)C1.CCN=c1[nH]c8cs1.c19nc(Cl)sc1C.C58=O.C69=O.N67
|
CCCCCOCC(=O)NC[C@H]1COC[C@H]1NC(=O)c1ccc(OCC)c(C)c1
|
CCCCCOCC=O)NC[C@H]COC[C@H]5NC=O)ccccOCC)))cC)c6
|
[C][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][O][C][C][C][Branch1][C][C][=C][Ring1][#Branch2]
|
c1%11ccc8c(C)c1.[C@H]13COC[C@H]1%10.CCCCC5.C6C2=O.C4%11=O.O56.N29.C93.N4%10.O78.C7C
|
CO[C@H]1C[C@@H](CNC(=O)[C@@H](C)C(C)C)N(C(=O)CCOC2CCC2)C1
|
CO[C@H]C[C@@H]CNC=O)[C@@H]C)CC)C))))))NC=O)CCOCCCC4))))))))C5
|
[C][O][C@H1][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Branch1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][O][C][C][C][C][Ring1][Ring2][C][Ring2][Ring1][#Branch1]
|
[C@H]16C[C@@H]9N4C1.C3(=O)[C@@H](C)C(C)C.C4(=O)CC5.C17CCC1.CO6.C89.N38.O57
|
CCCC=C(CC)C(=O)N1CC(COC)(NC(=O)C[C@@H](C)n2cccn2)C1
|
CCCC=CCC))C=O)NCCCOC)))NC=O)C[C@@H]C)ncccn5)))))))))C4
|
[C][C][C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][O][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][N][C][=C][C][=N][Ring1][Branch1][C][Ring2][Ring1][C]
|
C=7(CC)C3=O.N13CC69C1.C4(=O)C[C@H]8C.n18cccn1.CCCC=7.C59.O5C.N46
|
CN1CCN(C(=O)c2csc(C#N)c2)C[C@H]1CNC(=O)[C@H]1CCC12CCOCC2
|
CNCCNC=O)ccscC#N))c5))))))C[C@H]6CNC=O)[C@H]CCC4CCOCC6
|
[C][N][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][S][C][Branch1][Ring1][C][#N][=C][Ring1][#Branch1][C][C@H1][Ring1][#C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][Ring1][Ring2][C][C][O][C][C][Ring1][=Branch1]
|
[C@H]16CCC12CCOCC2.CN1CCN3C[C@H]18.c17csc(C#N)c1.C37=O.C46=O.C58.N45
|
C=C[C@@H](C)CC(=O)N[C@@H]1CN(C(=O)c2ncc(P(C)(C)=O)cn2)C[C@H]1O
|
C=C[C@@H]C)CC=O)N[C@@H]CNC=O)cnccPC)C)=O))cn6)))))))C[C@H]5O
|
[C][=C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=N][C][=C][Branch1][=Branch2][P][Branch1][C][C][Branch1][C][C][=O][C][=N][Ring1][#Branch2][C][C@H1][Ring1][P][O]
|
c16ncc(P(C)(C)=O)cn1.C=C[C@@H](C)CC3=O.[C@@H]15CN4C[C@H]1O.C46=O.N35
|
CCOC(=O)c1cc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)[C@@H](C)CC)C2)n(C)n1
|
CCOC=O)cccC=O)N[C@@H]CCC[C@@H]NC=O)[C@@H]C)CC)))))C6))))))))nC)n5
|
[C][C][O][C][=Branch1][C][=O][C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Branch1][N][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][C][Ring1][=N][N][Branch1][C][C][N][=Ring2][Ring1][=Branch1]
|
c19cc%10n(C)n1.[C@@H]17CCC[C@@H]8C1.C5(=O)[C@@H](C)CC.C39=O.C4%10=O.CC6.O36.N47.N58
|
CC(=O)N1CC[C@H](C(=O)N[C@@]23C[C@H]4CC[C@@H]([C@@H]2C3)N4C(=O)CC2=CCCCC2)C1
|
CC=O)NCC[C@H]C=O)N[C@@]C[C@H]CC[C@@H][C@@H]7C8))N5C=O)CC=CCCCC6)))))))))))))))))C5
|
[C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@][C][C@H1][C][C][C@@H1][Branch1][#Branch1][C@@H1][Ring1][#Branch1][C][Ring1][Branch2][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=C][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
[C@@]128C[C@H]3CC[C@@H]([C@@H]1C2)N37.C7(=O)CC1=CCCCC1.N15CC[C@H]9C1.CC5=O.C69=O.N68
|
CO[C@H](C)C(=O)N1CC2(CN(C(=O)[C@@H](O)C3=CCCCC3)CCO2)C1
|
CO[C@H]C)C=O)NCCCNC=O)[C@@H]O)C=CCCCC6))))))))CCO6)))))C4
|
[C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch2][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][C][C][C][Ring1][=Branch1][C][C][O][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14CC2(C1)CN5CCO2.C5(=O)[C@@H](O)C1=CCCCC1.[C@@H]6(C)C4=O.CO6
|
Cc1cc2[nH]c(C(=O)N3C[C@H](C)CN(C(=O)[C@H]4C[C@](O)(C#N)C4)[C@H](C)C3)cc2s1
|
Cccc[nH]cC=O)NC[C@H]C)CNC=O)[C@H]C[C@]O)C#N))C4)))))[C@H]C)C7))))))))cc5s8
|
[C][C][=C][C][NH1][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C@][Branch1][C][O][Branch1][Ring1][C][#N][C][Ring1][#Branch1][C@H1][Branch1][C][C][C][Ring2][Ring1][C][=C][C][=Ring2][Ring1][=Branch2][S][Ring2][Ring1][N]
|
N15C[C@H](C)CN6[C@H](C)C1.Cc1cc2[nH]c7cc2s1.[C@H]18C[C@](O)(C#N)C1.C57=O.C68=O
|
Cc1ccc(S(=O)(=O)N2C[C@@H]3[C@H](C2)[C@H]3C(=O)N2CCc3[nH]c(=N)sc3C2)c(F)c1
|
CccccS=O)=O)NC[C@@H][C@H]C5)[C@H]3C=O)NCCc[nH]c=N)sc5C9))))))))))))))))cF)c6
|
[C][C][=C][C][=C][Branch2][Ring2][Branch2][S][=Branch1][C][=O][=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][NH1][C][=Branch1][C][=N][S][C][=Ring1][=Branch1][C][Ring1][#Branch2][C][Branch1][C][F][=C][Ring2][Ring1][N]
|
Cc1ccc(S5(=O)=O)c(F)c1.N14CCc2[nH]c(=N)sc2C1.N15C[C@@H]2[C@@H]6[C@@H]2C1.C46=O
|
CC(C)CSCCC(=O)N1CCC[C@](CO)(NC(=O)COCC(C)(C)C)C1
|
CCC)CSCCC=O)NCCC[C@]CO))NC=O)COCCC)C)C)))))))C6
|
[C][C][Branch1][C][C][C][S][C][C][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][Ring1][C][O][Branch1][P][N][C][=Branch1][C][=O][C][O][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][C]
|
N12CCC[C@@]69C1.C8CC2=O.C5C(C)(C)C.CC(C)C7.C3(=O)C4.S78.C9O.N36.O45
|
Cc1cc(F)cc(C)c1C(=O)N1C[C@H]2C[C@H]1CN2S(=O)(=O)c1ccc(Cl)cn1
|
CcccF)ccC)c6C=O)NC[C@H]C[C@H]5CN5S=O)=O)ccccCl)cn6
|
[C][C][=C][C][Branch1][C][F][=C][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][N][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1]
|
S4(=O)(=O)c1ccc(Cl)cn1.Cc1cc(F)cc(C)c15.N13C[C@H]2C[C@H]1CN24.C35=O
|
CN(CCC(=O)N1CC[C@H](C(N)=O)C1)C(=O)[C@@H](F)C1(O)CCCC1
|
CNCCC=O)NCC[C@H]CN)=O))C5))))))))C=O)[C@@H]F)CO)CCCC5
|
[C][N][Branch2][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring1][Branch2][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][O][C][C][C][C][Ring1][=Branch1]
|
N12CC[C@H]5C1.C16(O)CCCC1.C4CC2=O.C3(=O)[C@H]6F.CN34.C5(N)=O
|
O=C(Cc1ccc2ncsc2c1)N1CC(c2ccc(Cl)cc2)C1
|
O=CCccccncsc5c9))))))))))NCCccccCl)cc6))))))C4
|
[O][=C][Branch1][#C][C][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2][N][C][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Ring1][O]
|
c14ccc2ncsc2c1.c15ccc(Cl)cc1.N13CC5C1.O=C3C4
|
C=C1CC(C)(C(=O)NCC2CCCN2C(=O)C(C)COC)C1
|
C=CCCC)C=O)NCCCCCN5C=O)CC)COC)))))))))))))C4
|
[C][=C][C][C][Branch1][C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][C][O][C][C][Ring2][Ring1][Branch1]
|
C=C1CC7(C)C1.C18CCCN14.C4(=O)C(C)C5.C37=O.N36.C68.O5C
|
C[C@@H]1CCCC[C@@H]1OCC(=O)NC[C@H]1CCCN1C(=O)[C@@H](C)N1CCSCC1
|
C[C@@H]CCCC[C@@H]6OCC=O)NC[C@H]CCCN5C=O)[C@@H]C)NCCSCC6
|
[C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][O][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][C][S][C][C][Ring1][=Branch1]
|
C[C@@H]1CCCC[C@@H]15.[C@H]18CCCN13.N17CCSCC1.C3(=O)[C@H]7C.C4C2=O.O45.N26.C68
|
CCO[C@H](C)C(=O)N[C@@](C)(CC)CNC(=O)c1c(C(C)C)nn(C)c1Cl
|
CCO[C@H]C)C=O)N[C@@]C)CC))CNC=O)ccCC)C))nnC)c5Cl
|
[C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@][Branch1][C][C][Branch1][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch2][Cl]
|
c18c9nn(C)c1Cl.[C@]6(C)(C7)CC.[C@@H]5(C)C2=O.C38=O.C9(C)C.CC4.O45.N26.N37
|
CCC(=O)NCC(=O)N1CCC(CCCNC(=O)c2cc(C)c(CC)s2)CC1
|
CCC=O)NCC=O)NCCCCCCNC=O)cccC)cCC))s5))))))))))CC6
|
[C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][C][C][S][Ring1][Branch2][C][C][Ring2][Ring1][Ring2]
|
N14CCC%10CC1.c18cc(C)c9s1.CCC3=O.C6C4=O.C%10CC7.C58=O.N36.N57.C9C
|
CO[C@H]1C[C@@H](NC(=O)[C@@H](CCSC)OC)CN(C(=O)CC2CCC(F)(F)CC2)C1
|
CO[C@H]C[C@@H]NC=O)[C@@H]CCSC))))OC)))))CNC=O)CCCCCF)F)CC6))))))))C6
|
[C][O][C@H1][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C@@H1][Branch1][Branch1][C][C][S][C][O][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][Ring2][Ring1][O]
|
[C@H]16C[C@@H]8CN4C1.C19CCC(F)(F)CC1.C3(=O)[C@H]5CC7.C4(=O)C9.CO6.N38.S7C.O5C
|
CC(C)c1nc(NCCc2ccccc2Br)cc(N2CCc3ccn(C)c3C2)n1
|
CCC)cncNCCcccccc6Br))))))))))ccNCCcccnC)c5C9)))))))))n6
|
[C][C][Branch1][C][C][C][=N][C][Branch1][=N][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][=C][C][Branch1][P][N][C][C][C][C][=C][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][#Branch2][=N][Ring2][Ring1][#Branch2]
|
N16CCc2ccn(C)c2C1.c17nc5cc6n1.c18ccccc1Br.CC7C.C4C8.N45
|
C#CCCO[C@@H](C)C(=O)N1CCC[C@@H](NC(=O)c2ccc(C=C)cc2)CC1
|
C#CCCO[C@@H]C)C=O)NCCC[C@@H]NC=O)ccccC=C))cc6))))))))CC7
|
[C][#C][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][=C][C][=C][Ring1][Branch2][C][C][Ring2][Ring1][C]
|
N13CCC[C@@H]7CC1.c18ccc(C=C)cc1.[C@H]6(C)C3=O.C#CCC5.C48=O.O56.N47
|
CCC1CC(C(=O)N2CCC[C@](O)(CNC(=O)c3cc4c(cn3)OCCC4)C2)C1
|
CCCCCC=O)NCCC[C@]O)CNC=O)cccccn6))OCCC6)))))))))))C6)))))))C4
|
[C][C][C][C][C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][O][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch1][C][=N][Ring1][=Branch1][O][C][C][C][Ring1][Branch2][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][O]
|
c18cc2c(cn1)OCCC2.N15CCC[C@@]%11(O)C1.C1%10CC9C1.C59=O.C68=O.CC%10.C7%11.N67
|
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