SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCOCC(=O)NCC[C@@H](O)CNC(=O)C=C(C)C(C)C
|
CCOCC=O)NCC[C@@H]O)CNC=O)C=CC)CC)C
|
[C][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][Branch1][C][C][C]
|
C5C[C@@H](O)C6.C=7(C)C(C)C.C4C1=O.C2(=O)C=7.CC3.O34.N15.N26
|
CC1=NO[C@@H](C(=O)NC2CC(C)(CNC(=O)C3(CCN(C)C)CC3)C2)C1
|
CC=NO[C@@H]C=O)NCCCC)CNC=O)CCCNC)C))))CC3))))))C4))))))C5
|
[C][C][=N][O][C@@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][C][Ring1][Branch2][C][Ring1][P][C][Ring2][Ring1][=Branch2]
|
CC1=NO[C@@H]9C1.C18CC%11(C)C1.C1%10%12CC1.C49=O.C5%10=O.C%12C7.N7(C)C.N48.C6%11.N56
|
COc1cc(OC)c(CN2CC[C@H](C)C3(CCCCC3)C2)c(C)c1Br
|
COcccOC))cCNCC[C@H]C)CCCCCC6)))))C6)))))))cC)c6Br
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][Branch2][Ring1][=Branch1][C][N][C][C][C@H1][Branch1][C][C][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][Ring1][N][C][Branch1][C][C][=C][Ring2][Ring1][=Branch1][Br]
|
N16CC[C@H](C)C2(CCCCC2)C1.c14cc5c7c(C)c1Br.CO4.O5C.C67
|
C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](C(=O)Nc2ncccc2Cl)C1
|
C[C@@H]Ccccccc6)))))))C=O)N[C@@H]CC[C@@H]C=O)Ncncccc6Cl)))))))))C5
|
[C][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C][=N][C][=C][C][=C][Ring1][=Branch1][Cl][C][Ring1][#C]
|
c15ncccc1Cl.C[C@@H](C8)C3=O.c18ccccc1.[C@@H]16CC[C@@H]7C1.C47=O.N36.N45
|
CC1(C)CC[C@H](C(=O)N[C@@H]2CCO[C@@H](c3ccccn3)C2)CO1
|
CCC)CC[C@H]C=O)N[C@@H]CCO[C@@H]cccccn6))))))C6))))))))CO6
|
[C][C][Branch1][C][C][C][C][C@H1][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C@@H1][C][C][O][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][C][O][Ring2][Ring1][=Branch1]
|
CC1(C)CC[C@H]6CO1.[C@@H]15CCO[C@@H]7C1.c17ccccn1.C46=O.N45
|
O=C([C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)N1Cc2cc(O)nnc2C1
|
O=C[C@H]CCCN5S=O)=O)cccc[N+]=O)[O-]))cc6))))))))))))NCcccO)nnc6C9
|
[O][=C][Branch2][Ring1][=C][C@H1][C][C][C][N][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][N][C][C][=C][C][Branch1][C][O][=N][N][=C][Ring1][#Branch1][C][Ring1][#Branch2]
|
S4(=O)(=O)c1ccc([N+](=O)[O-])cc1.N13Cc2cc(O)nnc2C1.[C@H]15CCCN14.O=C35
|
CC(C)NC(=NCCC[C@@H]1CCCCO1)NC[C@@](C)(O)C1CCCC1
|
CCC)NC=NCCC[C@@H]CCCCO6))))))))))NC[C@@]C)O)CCCCC5
|
[C][C][Branch1][C][C][N][C][=Branch1][=N][=N][C][C][C][C@@H1][C][C][C][C][O][Ring1][=Branch1][N][C][C@@][Branch1][C][C][Branch1][C][O][C][C][C][C][C][Ring1][Branch1]
|
N2C(=NCCC4)N3.[C@@H]14CCCCO1.C3[C@@]5(C)O.C15CCCC1.CC2C
|
CO[C@@H]1CN(C(=O)CNC(N)=O)[C@](C)(CNC(=O)c2cc3n(c2)CCCC3)C1
|
CO[C@@H]CNC=O)CNCN)=O)))))[C@]C)CNC=O)cccnc5)CCCC6)))))))))))C5
|
[C][O][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][N][C][Branch1][C][N][=O][C@][Branch1][C][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][C][=Ring1][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][#Branch2]
|
c1%10cc2n(c1)CCCC2.[C@@H]17CN4[C@@]%11(C)C1.C4(=O)C8.C5(N)=O.C6%10=O.CO7.N58.C9%11.N69
|
C=CC[C@H](CC(C)C)C(=O)N[C@@H]1CCN(C(=O)C(C)(C)OCC)C[C@@H]1C
|
C=CC[C@H]CCC)C)))C=O)N[C@@H]CCNC=O)CC)C)OCC)))))C[C@@H]6C
|
[C][=C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][O][C][C][C][C@@H1][Ring1][=C][C]
|
C=CC[C@H](CC(C)C)C2=O.[C@@H]16CCN3C[C@@H]1C.C3(=O)C4(C)C.N26.O45.C5C
|
CCC(C)(C)n1nnnc1[C@]1(Nc2ccc3c(c2)CNC3=O)CCC[C@@H]1C1CC1
|
CCCC)C)nnnnc5[C@]Ncccccc6)CNC5=O))))))))))CCC[C@@H]5CCC3
|
[C][C][C][Branch1][C][C][Branch1][C][C][N][N][=N][N][=C][Ring1][Branch1][C@][Branch2][Ring1][C][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][C][Ring1][=Branch1][=O][C][C][C][C@@H1][Ring1][S][C][C][C][Ring1][Ring1]
|
c15ccc2c(c1)CNC2=O.[C@]147CCC[C@@H]1C1CC1.n16nnnc17.CCC6(C)C.N45
|
O=C(N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc[nH]1
|
O=CN[C@H]C[C@H]CC[C@@H]6N5C=O)[C@@H]CC=O)Ncccccc6))))))C5))))))))))))))cccc[nH]5
|
[O][=C][Branch2][Ring2][Branch1][N][C@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][C][=C][C][=C][NH1][Ring1][Branch1]
|
[C@H]15C[C@H]2CC[C@@H]1N24.[C@@H]17CC(=O)N8C1.c18ccccc1.c16ccc[nH]1.O=C36.C47=O.N35
|
C#CC[C@H](C(=O)N1CC(C)(C)C[C@H]1CNC(=O)C(F)=CC)C1CC1
|
C#CC[C@H]C=O)NCCC)C)C[C@H]5CNC=O)CF)=CC))))))))))))CCC3
|
[C][#C][C][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][F][=C][C][C][C][C][Ring1][Ring1]
|
N12CC(C)(C)C[C@H]16.C#CC[C@@H]7C2=O.C3(=O)C=5F.C17CC1.C46.N34.C=5C
|
C[C@@H]1CCN(c2nc(Cl)nc3ncn(C)c23)C[C@@H]1NC(=O)[C@@H]1CCO[C@H]1C
|
C[C@@H]CCNcncCl)ncncnC)c95)))))))))C[C@@H]6NC=O)[C@@H]CCO[C@H]5C
|
[C][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=N][C][Branch1][C][Cl][=N][C][N][=C][N][Branch1][C][C][C][Ring1][O][=Ring1][=Branch1][C][C@@H1][Ring1][P][N][C][=Branch1][C][=O][C@@H1][C][C][O][C@H1][Ring1][Branch1][C]
|
c15nc(Cl)nc2ncn(C)c12.C[C@@H]1CCN5C[C@@H]16.[C@@H]17CCO[C@H]1C.C47=O.N46
|
CN1CC[C@@H](C(=O)NCC[C@@]2(O)CCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1
|
CNCC[C@@H]C=O)NCC[C@@]O)CCNC=O)ccccnc[nH]c5c9))))))))))C5)))))))))C5
|
[C][N][C][C][C@@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][N][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring1][P][C][Ring2][Ring1][O]
|
c19ccc2nc[nH]c2c1.[C@]1%10(O)CCN6C1.CN1CC[C@@H]8C1.C58=O.C7C%10.C69=O.N57
|
CC(C)[C@@H](CCNC(=O)CSC1CC1)NC(=O)c1cccc(-c2cccs2)n1
|
CCC)[C@@H]CCNC=O)CSCCC3)))))))))NC=O)ccccc-ccccs5)))))n6
|
[C][C][Branch1][C][C][C@@H1][Branch1][#C][C][C][N][C][=Branch1][C][=O][C][S][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=N][Ring1][O]
|
CC(C)[C@H]5CC6.c18cccc%10n1.c1%10cccs1.C3(=O)C7.C19CC1.C48=O.N36.S79.N45
|
CCN(C(=O)CCCCC1CC1)[C@@H]1CCCN(C(=O)CC(F)(F)Cl)CC1
|
CCNC=O)CCCCCCC3))))))))[C@@H]CCCNC=O)CCF)F)Cl))))CC7
|
[C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][Ring1][C@@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][Cl][C][C][Ring1][=C]
|
[C@@H]15CCCN3CC1.C2(=O)CCCC6.C3(=O)CC(F)(F)Cl.N245.C16CC1.CC4
|
O=C(Nc1nc(O)nc(O)n1)[C@H]1CCN(Cc2cc(F)c(F)cc2O)C1
|
O=CNcncO)ncO)n6)))))))[C@H]CCNCcccF)cF)cc6O))))))))C5
|
[O][=C][Branch1][S][N][C][=N][C][Branch1][C][O][=N][C][Branch1][C][O][=N][Ring1][Branch2][C@H1][C][C][N][Branch1][P][C][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][O][C][Ring1][#C]
|
c17cc(F)c(F)cc1O.c15nc(O)nc(O)n1.[C@H]16CCN4C1.O=C36.N35.C47
|
Cc1csc2c(C(=O)NCC3(F)CN(C(=O)CCC(N)=O)C3)ncnc12
|
CccsccC=O)NCCF)CNC=O)CCCN)=O)))))C4)))))))ncnc96
|
[C][C][=C][S][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][N][=O][C][Ring1][N][N][=C][N][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][=Branch1]
|
Cc1csc2c7ncnc12.C5(=O)CCC(N)=O.C18(F)CN5C1.C47=O.N46.C68
|
C#CC[C@H](O)C(=O)N[C@H]1CCCC[C@H]1NC(=O)c1[nH]c2ccc(F)cc2c1C
|
C#CC[C@H]O)C=O)N[C@H]CCCC[C@H]6NC=O)c[nH]ccccF)cc6c9C
|
[C][#C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][C]
|
c17[nH]c2ccc(F)cc2c1C.C#CC[C@H](O)C3=O.[C@H]15CCCC[C@H]16.C47=O.N35.N46
|
O=C([C@@H]1CC[C@H](C2CC2)C1)N1CC2(CO)CC1(C(=O)N1C[C@H]3CCC[C@@H](C3)C1)C2
|
O=C[C@@H]CC[C@H]CCC3)))C5)))))NCCCO))CC5C=O)NC[C@H]CCC[C@@H]C6)C8)))))))))C4
|
[O][=C][Branch1][#C][C@@H1][C][C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][Branch2][N][C][C][Branch1][Ring1][C][O][C][C][Ring1][#Branch1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][P]
|
N15C[C@H]2CCC[C@@H](C2)C1.[C@@H]17CC[C@H](C2CC2)C1.N14CC28CC16C2.O=C47.C56=O.C8O
|
CN1CCN(CC(=O)NCC2(NC(=O)[C@@H]3COC(=O)C3)CCCCC2)CC1=O
|
CNCCNCC=O)NCCNC=O)[C@@H]COC=O)C5)))))))CCCCC6))))))))))CC6=O
|
[C][N][C][C][N][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][C][C][C][C][C][Ring1][#C][C][C][Ring2][Ring1][#Branch2][=O]
|
CN1CCN6CC1=O.C18%10CCCCC1.[C@@H]19COC(=O)C1.C6C4=O.C59=O.N47.C7%10.N58
|
CC[C@@H]1CCN[C@H](C(=O)N[C@@H](C)c2ccc(Br)cc2C)C1
|
CC[C@@H]CCN[C@H]C=O)N[C@@H]C)ccccBr)cc6C))))))))))C6
|
[C][C][C@@H1][C][C][N][C@H1][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][Ring1]
|
c17ccc(Br)cc1C.[C@@H]16CCN[C@H]5C1.C35=O.[C@@H]47C.CC6.N34
|
Cc1cc(N)ccc1C(=O)N(C)C1CN(C(=O)[C@@H]2CC(c3ccccn3)=NO2)C1
|
CcccN)ccc6C=O)NC)CCNC=O)[C@@H]CCcccccn6))))))=NO5))))))C4
|
[C][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][=N][O][Ring1][O][C][Ring1][P]
|
[C@@H]17CC(c2ccccn2)=NO1.Cc1cc(N)ccc18.C16CN5C1.C48=O.N46C.C57=O
|
CC(=O)NCC(=O)NC1CCC2(CC1)CN(C(=O)[C@H]1COc3ccccc3C1)C2
|
CC=O)NCC=O)NCCCCCC6))CNC=O)[C@H]COcccccc6C%10)))))))))))C4
|
[C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][Ring2][Ring1][C]
|
C18CCC2(CC1)CN6C2.[C@H]19COc2ccccc2C1.C7C5=O.CC4=O.C69=O.N47.N58
|
CC(C)Nc1cc(Br)ccc1S(=O)(=O)N1CCN(C)c2ccccc2C1
|
CCC)NcccBr)ccc6S=O)=O)NCCNC)cccccc6C%11
|
[C][C][Branch1][C][C][N][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N]
|
N14CCN(C)c2ccccc2C1.c15cc(Br)ccc1S4(=O)=O.CC3C.N35
|
C[C@@H](CNC(=O)c1ncsc1Br)CN(C)C(=O)c1cccc2c[nH]nc12
|
C[C@@H]CNC=O)cncsc5Br)))))))))CNC)C=O)cccccc[nH]nc95
|
[C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][N][=C][S][C][=Ring1][Branch1][Br][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][NH1][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
c18cccc2c[nH]nc12.c17ncsc1Br.C[C@@H](C5)C6.C37=O.N46C.C48=O.N35
|
N#Cc1nc[nH]c1C(=O)NCCNC(=O)c1ccc(-c2nnc(S)o2)cc1
|
N#Ccnc[nH]c5C=O)NCCNC=O)cccc-cnncS)o5)))))cc6
|
[N][#C][C][N][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][C][=N][N][=C][Branch1][C][S][O][Ring1][=Branch1][C][=C][Ring1][N]
|
N#Cc1nc[nH]c17.c18ccc9cc1.c19nnc(S)o1.C37=O.C5C6.C48=O.N35.N46
|
Cc1cn2ccnc(C(=O)N[C@H]3CCC[C@@H](NC(=O)C[C@@H]4CCOC4)C3)c2n1
|
CccnccncC=O)N[C@H]CCC[C@@H]NC=O)C[C@@H]CCOC5))))))))C6))))))))c6n9
|
[C][C][=C][N][C][=C][N][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@H1][C][C][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring1][#C][C][Ring2][Ring1][Branch2][=N][Ring2][Ring1][O]
|
Cc1cn2ccnc9c2n1.[C@H]17CCC[C@@H]8C1.[C@@H]1%10CCOC1.C6(=O)C%10.C59=O.N57.N68
|
Cc1cccc(F)c1C(=O)NCCN(C[C@H](C)O)C(=O)C#CC1CC1
|
CcccccF)c6C=O)NCCNC[C@H]C)O)))C=O)C#CCCC3
|
[C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C@H1][Branch1][C][C][O][C][=Branch1][C][=O][C][#C][C][C][C][Ring1][Ring1]
|
Cc1cccc(F)c17.C3(=O)C#CC1CC1.C6[C@H](C)O.C27=O.C4C5.N356.N24
|
COC1(C)CN(CC(=O)NC[C@@H]2CN(C(=O)C[C@@H](C)CC(C)C)C3(CCC3)C2)C1
|
COCC)CNCC=O)NC[C@@H]CNC=O)C[C@@H]C)CCC)C))))))CCCC4)))C5)))))))))C4
|
[C][O][C][Branch1][C][C][C][N][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][C][Branch1][C][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][P][C][Ring2][Ring1][O]
|
[C@@H]19CN5C2(CCC2)C1.C5(=O)C[C@@H](C)CC(C)C.C16(C)CN7C1.C7C4=O.CO6.N48.C89
|
CCN(CC)C(=O)C1(CCNC(=O)C[C@H]2CCOC2(C)C)CCCC1
|
CCNCC))C=O)CCCNC=O)C[C@H]CCOC5C)C)))))))))))CCCC5
|
[C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][C@H1][C][C][O][C][Ring1][Branch1][Branch1][C][C][C][C][C][C][C][Ring2][Ring1][C]
|
[C@H]1%10CCOC1(C)C.C189CCCC1.C4(=O)C%10.N356.C38=O.C9C7.CC5.C6C.N47
|
CNC(=O)N1CC(C(=O)N2CCC[C@H](N(C)C(=O)COC[C@H]3CCCOC3)C2)C1
|
CNC=O)NCCC=O)NCCC[C@H]NC)C=O)COC[C@H]CCCOC6)))))))))))C6)))))))C4
|
[C][N][C][=Branch1][C][=O][N][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Ring2][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch2]
|
N16CCC[C@H]%10C1.[C@H]1%12CCCOC1.N15CC%11C1.C7(=O)C8.C45=O.C6%11=O.N7%10C.CN4.O89.C9%12
|
Cc1c(NCc2ccc(Br)cc2N)ncnc1N[C@@H](C)c1ccccc1C(C)C
|
CccNCccccBr)cc6N)))))))))ncnc6N[C@@H]C)cccccc6CC)C
|
[C][C][=C][Branch1][#C][N][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][N][=C][N][=C][Ring1][S][N][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C]
|
Cc1c5ncnc16.c17ccc(Br)cc1N.c18ccccc19.[C@@H]48C.C9(C)C.N35.C37.N46
|
Cc1n[nH]c(C)c1SCC(=O)N[C@H]1C[C@@H](CCNC(=O)C2(N(C)C)CCC2)C1
|
Ccn[nH]cC)c5SCC=O)N[C@H]C[C@@H]CCNC=O)CNC)C))CCC4))))))))C4
|
[C][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][S][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][N][Branch1][C][C][C][C][C][C][Ring1][#Branch1][C][Ring1][S]
|
Cc1n[nH]c(C)c1%11.[C@H]18C[C@@H]%10C1.C169CCC1.C7C3=O.C%10C5.C49=O.N6(C)C.S7%11.N38.N45
|
CCCC[C@@H](CNC(=O)c1cc(C)sc1C)NC(=O)c1ccc(C)nc1C
|
CCCC[C@@H]CNC=O)cccC)sc5C)))))))))NC=O)ccccC)nc6C
|
[C][C][C][C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C]
|
c17ccc(C)nc1C.CCCC[C@H]4C5.c16cc(C)sc1C.C26=O.C37=O.N25.N34
|
C[C@H]1[C@H]2CC[C@H](C[C@H]1NC(=O)C1(C)COC1)N2C(=O)C[C@@H](C(F)F)n1ccnc1
|
C[C@H][C@H]CC[C@H]C[C@H]7NC=O)CC)COC4))))))))N5C=O)C[C@@H]CF)F))nccnc5
|
[C][C@H1][C@H1][C][C][C@H1][Branch2][Ring1][Ring1][C][C@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][C][Branch1][C][C][C][O][C][Ring1][Branch1][N][Ring1][#C][C][=Branch1][C][=O][C][C@@H1][Branch1][=Branch1][C][Branch1][C][F][F][N][C][=C][N][=C][Ring1][Branch1]
|
C[C@@H]1[C@H]5C[C@H]2CC[C@H]1N24.C4(=O)C[C@H]7C(F)F.C16(C)COC1.n17ccnc1.C36=O.N35
|
C=CCCC(C)(C)C(=O)N1CCC[C@@H](CNC(=O)c2csc([C@@H](C)OC)n2)C1
|
C=CCCCC)C)C=O)NCCC[C@@H]CNC=O)ccsc[C@@H]C)OC)))n5))))))))C6
|
[C][=C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][#Branch1][C@@H1][Branch1][C][C][O][C][=N][Ring1][=Branch2][C][Ring2][Ring1][Ring1]
|
C=CCCC(C)(C)C3=O.N13CCC[C@@H]9C1.c17csc8n1.C47=O.[C@H]58C.C69.N46.O5C
|
C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)CC2CCC2)cc1)[C@H](O)c1ccccc1
|
C[C@H]NC=O)ccccS=O)=O)NC)CCCCC4)))))))cc6))))))))[C@H]O)cccccc6
|
[C][C@H1][Branch2][Ring2][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][C][Ring1][Ring2][C][=C][Ring1][S][C@H1][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
c17ccc(S6(=O)=O)cc1.c19ccccc1.C[C@H]4[C@@H]9O.C18CCC1.C37=O.N56C.N34.C58
|
CC1(C)CCO[C@@H]1C(=O)N[C@@H](CCF)C(=O)NC[C@H]1C[C@@](C)(O)C1
|
CCC)CCO[C@@H]5C=O)N[C@@H]CCF)))C=O)NC[C@H]C[C@@]C)O)C4
|
[C][C][Branch1][C][C][C][C][O][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring2][C][C][F][C][=Branch1][C][=O][N][C][C@H1][C][C@@][Branch1][C][C][Branch1][C][O][C][Ring1][=Branch1]
|
CC1(C)CCO[C@@H]16.[C@H]4(CCF)C3=O.[C@H]17C[C@@](C)(O)C1.C26=O.N24.N35.C57
|
CSc1cscc1C(=O)NCC1CC(NC(=O)[C@@H]2CCN2Cc2ccccc2)C1
|
CSccscc5C=O)NCCCCNC=O)[C@@H]CCN4Ccccccc6)))))))))))))C4
|
[C][S][C][=C][S][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][N][Ring1][Ring2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
c14cscc1%10.c1%12ccccc1.C1%11CC8C1.[C@@H]19CCN17.C3%10=O.C59=O.CS4.N36.C6%11.N58.C7%12
|
C[C@@H](C(=O)NCC1(NC(=O)[C@H]2COC3(CO)CC2C3)CCCCCC1)C1CC1
|
C[C@@H]C=O)NCCNC=O)[C@H]COCCO))CC6C4)))))))))CCCCCC7))))))))))CCC3
|
[C][C@@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][C][O][C][Branch1][Ring1][C][O][C][C][Ring1][Branch2][C][Ring1][=Branch1][C][C][C][C][C][C][Ring2][Ring1][Ring1][C][C][C][Ring1][Ring1]
|
C17%11CCCCCC1.[C@H]18COC29CC1C2.C[C@H]%10C4=O.C58=O.C1%10CC1.N46.C6%11.N57.C9O
|
CCCN(C(=O)CCc1nc[nH]n1)[C@@H]1CCN(C(=O)CCc2c(C)n[nH]c2C)C1
|
CCCNC=O)CCcnc[nH]n5))))))))[C@@H]CCNC=O)CCccC)n[nH]c5C)))))))))C5
|
[C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][N][=C][NH1][N][=Ring1][Branch1][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][=N][NH1][C][=Ring1][=Branch1][C][C][Ring1][S]
|
c18c(C)n[nH]c1C.[C@@H]16CCN4C1.C3(=O)CC7.c17nc[nH]n1.C4(=O)CC8.CCC5.N356
|
COCCCC(=O)N1C[C@@H]2CN(C(=O)[C@H]3CN4CCC[C@H]3C4)C[C@@H]2C1
|
COCCCC=O)NC[C@@H]CNC=O)[C@H]CNCCC[C@H]7C6)))))))))C[C@@H]5C8
|
[C][O][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][N][C][C][C][C@H1][Ring1][#Branch1][C][Ring1][=Branch1][C][C@@H1][Ring1][#C][C][Ring2][Ring1][C]
|
N15C[C@@H]2CN6C[C@@H]2C1.[C@H]18CN2CCC[C@H]1C2.C7CCC5=O.C68=O.CO7
|
CC(C)(C)[C@H](C(=O)N[C@@H]1CN(C(=O)c2cc(F)n[nH]2)CC[C@H]1O)C1CCC1
|
CCC)C)[C@H]C=O)N[C@@H]CNC=O)cccF)n[nH]5))))))CC[C@H]6O)))))))))CCCC4
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=N][NH1][Ring1][=Branch1][C][C][C@H1][Ring1][=C][O][C][C][C][C][Ring1][Ring2]
|
CC(C)(C)[C@@H]7C3=O.[C@@H]15CN4CC[C@H]1O.c16cc(F)n[nH]1.C17CCC1.C46=O.N35
|
CC1(NC(=O)c2cc3c(F)c(F)ccc3s2)CN(C(=O)[C@@]2(C)C[C@@]2(F)Cl)C1
|
CCNC=O)ccccF)cF)ccc6s9)))))))))))CNC=O)[C@@]C)C[C@@]3F)Cl)))))C4
|
[C][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][C][=C][Ring1][Branch2][S][Ring1][O][C][N][Branch1][P][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C@@][Ring1][Ring2][Branch1][C][F][Cl][C][Ring2][Ring1][#Branch2]
|
c17cc2c(F)c(F)ccc2s1.CC16CN5C1.[C@]18(C)C[C@@]1(F)Cl.C47=O.C58=O.N46
|
CC1(C)CN(C(=O)[C@@H]2COC(=O)O2)CC[C@H]1NC(=O)[C@@H]1CCCCN1CC(F)F
|
CCC)CNC=O)[C@@H]COC=O)O5))))))CC[C@H]6NC=O)[C@@H]CCCCN6CCF)F
|
[C][C][Branch1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][O][Ring1][=Branch1][C][C][C@H1][Ring1][#C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][C][Branch1][C][F][F]
|
CC1(C)CN3CC[C@H]16.[C@@H]18CCCCN15.[C@@H]17COC(=O)O1.C5C(F)F.C37=O.C48=O.N46
|
COCCSc1ccc([C@@H](C)N[C@@H](C)c2cccc(Cl)c2C)cc1
|
COCCScccc[C@@H]C)N[C@@H]C)cccccCl)c6C))))))))))cc6
|
[C][O][C][C][S][C][=C][C][=C][Branch2][Ring1][=Branch1][C@@H1][Branch1][C][C][N][C@@H1][Branch1][C][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][=C][Ring2][Ring1][Ring1]
|
c18cccc(Cl)c1C.c19ccc7cc1.C3C6.[C@H]47C.[C@@H]58C.CO3.S69.N45
|
CC(C)c1ocnc1C(=O)N1CCO[C@H](CC(=O)N2CCC[C@@H](N(C)C)C2)C1
|
CCC)cocnc5C=O)NCCO[C@H]CC=O)NCCC[C@@H]NC)C))C6))))))))C6
|
[C][C][Branch1][C][C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch2][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][=Branch2][C][Ring2][Ring1][C]
|
N13CCO[C@H]7C1.N14CCC[C@@H]5C1.c18ocnc16.C7C4=O.CC8C.C36=O.N5(C)C
|
CCc1cnc(O)c(C(=O)NCC(C)(C)CNC(=O)[C@@H]2CC[C@@H](OC)C2)c1
|
CCccncO)cC=O)NCCC)C)CNC=O)[C@@H]CC[C@@H]OC))C5))))))))))))c6
|
[C][C][C][=C][N][=C][Branch1][C][O][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Branch1][Ring1][O][C][C][Ring1][#Branch1][=C][Ring2][Ring1][=Branch2]
|
c1%10cnc(O)c9c1.C6C(C)(C)C7.[C@@H]18CC[C@@H]5C1.C39=O.C48=O.CC%10.N36.N47.O5C
|
C[C@H](CNC(=O)CC1(CO)CC1)NC(=O)CCS(=O)(=O)c1ccc(F)cc1
|
C[C@H]CNC=O)CCCO))CC3)))))))NC=O)CCS=O)=O)ccccF)cc6
|
[C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][O][C][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
C3(=O)CCS(=O)(=O)c1ccc(F)cc1.C[C@@H]4C5.C2(=O)C6.C167CC1.N25.C7O.N34
|
CC1=C[C@H](O)CN(C(=O)NCCCN2C[C@@H](C)O[C@@H](C)C2)C1
|
CC=C[C@H]O)CNC=O)NCCCNC[C@@H]C)O[C@@H]C)C6)))))))))))C6
|
[C][C][=C][C@H1][Branch1][C][O][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][N][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][Ring1][Branch2][C][Ring2][Ring1][Branch1]
|
CC1=C[C@H](O)CN3C1.N16C[C@@H](C)O[C@@H](C)C1.C5CC6.C34=O.N45
|
CCCC[C@H](CNC(=O)c1cnc(C)s1)NC(=O)[C@H](C)CC(F)F
|
CCCC[C@H]CNC=O)ccncC)s5))))))))NC=O)[C@H]C)CCF)F
|
[C][C][C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][S][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][Branch1][C][F][F]
|
C3(=O)[C@H](C)CC(F)F.CCCC[C@@H]4C5.c16cnc(C)s1.C26=O.N25.N34
|
CCc1cc(N[C@@]23CC[C@@H](C[C@H]2NC(=O)[C@@H]2C[C@H]4C=CC[C@@H](C4)C2)C3)ncn1
|
CCcccN[C@@]CC[C@@H]C[C@H]6NC=O)[C@@H]C[C@H]C=CC[C@@H]C6)C8))))))))))))C5))))))ncn6
|
[C][C][C][=C][C][Branch2][Ring2][Branch1][N][C@@][C][C][C@@H1][Branch2][Ring1][=Branch2][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@H1][C][=C][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring2][Ring1][Ring1][=N][C][=N][Ring2][Ring1][#Branch2]
|
[C@@H]19C[C@H]2C=CC[C@H](C1)C2.[C@@]127CC[C@@H](C[C@H]18)C2.c1%10cc6ncn1.C59=O.CC%10.N67.N58
|
O=C(CCc1cccnc1)NCC[C@@H]1CCN(C(=O)c2ccc(Cl)c(F)c2O)C1
|
O=CCCccccnc6))))))))NCC[C@@H]CCNC=O)ccccCl)cF)c6O))))))))C5
|
[O][=C][Branch1][O][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][F][=C][Ring1][Branch2][O][C][Ring1][S]
|
c16ccc(Cl)c(F)c1O.c18cccnc1.[C@@H]17CCN4C1.O=C3CC8.C5C7.C46=O.N35
|
CO[C@@H]1C[C@@H](CNC(=O)c2ccc(CSC)o2)N(C(=O)CSc2cccs2)C1
|
CO[C@@H]C[C@@H]CNC=O)ccccCSC)))o5))))))))NC=O)CSccccs5))))))))C5
|
[C][O][C@@H1][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][C][S][C][O][Ring1][Branch2][N][Branch1][=C][C][=Branch1][C][=O][C][S][C][=C][C][=C][S][Ring1][Branch1][C][Ring2][Ring1][#Branch2]
|
[C@@H]16C[C@@H]%11N5C1.c1%10ccc%12o1.c14cccs1.C5(=O)C9.C3%10=O.CO6.C7%11.N37.C8%12.S8C.S94
|
COc1ccc(SC(C)C(=O)NC[C@@H](C)N(C)C(=O)c2ccc(O)c(C)c2)cc1
|
COccccSCC)C=O)NC[C@@H]C)NC)C=O)ccccO)cC)c6))))))))))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][S][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][Branch2][C][=C][Ring2][Ring1][O]
|
c19ccc(O)c(C)c1.c15ccc%10cc1.C8(C)C3=O.C6[C@H]7C.N47C.C49=O.CO5.S8%10.N36
|
CC(C)[C@H](NS(=O)(=O)c1cc(F)c(F)cc1F)C1CC1
|
CCC)[C@H]NS=O)=O)cccF)cF)cc6F)))))))))CCC3
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][Branch2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][F][C][C][C][Ring1][Ring1]
|
S3(=O)(=O)c1cc(F)c(F)cc1F.CC(C)[C@H]24.C14CC1.N23
|
CC(C)CCC(=O)NCC[C@@H]1CCN(C(=O)C#CC2(C(F)(F)F)CC2)C1
|
CCC)CCC=O)NCC[C@@H]CCNC=O)C#CCCF)F)F))CC3))))))C5
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][#C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch1][C][Ring1][S]
|
C4(=O)C#CC17CC1.CC(C)CCC3=O.[C@@H]16CCN4C1.C7(F)(F)F.C5C6.N35
|
CSC=CC(=O)NCC1(C)CCN(C(=O)c2cncc(-c3cc[nH]n3)c2)CC1
|
CSC=CC=O)NCCC)CCNC=O)ccncc-ccc[nH]n5)))))c6)))))))CC6
|
[C][S][C][=C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][=C][Ring1][O][C][C][Ring2][Ring1][Ring2]
|
C18(C)CCN5CC1.c17cncc9c1.CSC=CC4=O.c19cc[nH]n1.C57=O.N46.C68
|
COC1(CNC(=O)C2=NOCC2)CN(C(=O)COc2ccc(Cl)c(Cl)c2)C1
|
COCCNC=O)C=NOCC5))))))))CNC=O)COccccCl)cCl)c6)))))))))C4
|
[C][O][C][Branch1][=C][C][N][C][=Branch1][C][=O][C][=N][O][C][C][Ring1][Branch1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Ring2][Ring1][=Branch2]
|
c17ccc(Cl)c(Cl)c1.C3(=O)C1=NOCC1.C159CN4C1.C4(=O)C6.CO5.C89.N38.O67
|
C[C@H]1C[C@@H](NC(=O)c2cnc3ncccn23)CCN1C(=O)[C@H](C)C1(O)CCC1
|
C[C@H]C[C@@H]NC=O)ccncncccn96)))))))))))CCN6C=O)[C@H]C)CO)CCC4
|
[C][C@H1][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][O][C][C][C][Ring1][Branch1]
|
c17cnc2ncccn12.C[C@H]1C[C@@H]6CCN15.C5(=O)[C@@H]8C.C18(O)CCC1.C47=O.N46
|
C[C@@H]1CCN(c2ccn3ccnc3n2)[C@H](C)[C@H]1NC(=O)c1cc2ccccc2o1
|
C[C@@H]CCNcccnccnc5n9)))))))))[C@H]C)[C@H]6NC=O)cccccccc6o9
|
[C][C@@H1][C][C][N][Branch1][=C][C][C][=C][N][C][=C][N][=C][Ring1][Branch1][N][=Ring1][=Branch2][C@H1][Branch1][C][C][C@H1][Ring1][S][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2]
|
C[C@@H]1CCN5[C@H](C)[C@H]16.c15ccn2ccnc2n1.c17cc2ccccc2o1.C47=O.N46
|
C=CC[C@@H](CNC(=O)c1cnnn1C(C)C)NC(=O)CCC1(C)CC1
|
C=CC[C@@H]CNC=O)ccnnn5CC)C))))))))))NC=O)CCCC)CC3
|
[C][=C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][N][=N][N][Ring1][Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][C][Ring1][Ring2]
|
C=CC[C@H]4C5.c16cnnn17.C3(=O)CC8.C18(C)CC1.C26=O.C7(C)C.N25.N34
|
CCCc1nc(C)c(C(=O)N[C@@H]2CC[C@@H]2NC(=O)C(=O)NCC)s1
|
CCCcncC)cC=O)N[C@@H]CC[C@@H]4NC=O)C=O)NCC))))))))))))s5
|
[C][C][C][C][=N][C][Branch1][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][=Branch1][C][=O][N][C][C][S][Ring2][Ring1][Branch1]
|
c1%10nc(C)c9s1.[C@@H]17CC[C@@H]18.C4(=O)C5=O.CCC%10.C39=O.N37.N48.N56.C6C
|
C[C@@H]1[C@@H](NC(=O)[C@H]2CN3CCN2CC3)CCCN1C(=O)c1cnn(C2CC2)c1
|
C[C@@H][C@@H]NC=O)[C@H]CNCCN6CC6))))))))))CCCN6C=O)ccnnCCC3)))c5
|
[C][C@@H1][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][C][N][C][C][N][Ring1][=Branch1][C][C][Ring1][=Branch1][C][C][C][N][Ring1][P][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=Ring1][Branch2]
|
C[C@@H]1[C@@H]6CCCN15.[C@H]17CN2CCN1CC2.c18cnn9c1.C47=O.C58=O.C19CC1.N46
|
C=C(C)CCC(=O)N[C@H](C)[C@@H]1CCN(C(=O)c2ccc3cccc(O)c3c2)C1
|
C=CC)CCC=O)N[C@H]C)[C@@H]CCNC=O)ccccccccO)c6c%10)))))))))))C5
|
[C][=C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Branch1][C][O][C][Ring1][#Branch1][=C][Ring1][O][C][Ring2][Ring1][C]
|
c17ccc2cccc(O)c2c1.C=C(C)CCC4=O.[C@@H]18CCN5C1.[C@H]68C.C57=O.N46
|
CC(=O)c1ccc(C(=O)NC[C@H]2C[C@H]2NC(=O)c2c(C)ccc(Br)c2C)nc1
|
CC=O)ccccC=O)NC[C@H]C[C@H]3NC=O)ccC)cccBr)c6C)))))))))))))))nc6
|
[C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][C][Branch1][C][Br][=C][Ring1][Branch2][C][N][=C][Ring2][Ring1][=Branch2]
|
c19c(C)ccc(Br)c1C.c18ccc7nc1.[C@H]1%10C[C@H]16.CC8=O.C37=O.C49=O.N35.C5%10.N46
|
CCCCc1ccc(C(=O)COC(=O)c2ccccc2C(F)(F)C(F)(F)F)cc1
|
CCCCccccC=O)COC=O)cccccc6CF)F)CF)F)F)))))))))))))cc6
|
[C][C][C][C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring2][Ring1][=Branch2]
|
c17ccc5cc1.c16ccccc18.C8(F)(F)C(F)(F)F.CCCC7.C5(=O)C4.C36=O.O34
|
CCCC[C@@H](CNC(=O)C(C)(C)OC(C)=O)NC(=O)[C@@H]1CC(=O)N[C@H](C)C1
|
CCCC[C@@H]CNC=O)CC)C)OCC)=O)))))))NC=O)[C@@H]CC=O)N[C@H]C)C6
|
[C][C][C][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][O][C][Branch1][C][C][=O][N][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][Ring1][Branch2]
|
[C@@H]18CC(=O)N[C@H](C)C1.CCCC[C@H]6C7.C3(=O)C5(C)C.C2(C)=O.C48=O.N37.O25.N46
|
CC[C@H](CC(=O)N1CCC(C)(C)[C@@H]1C(=O)N1CCCCCC1)CN(C)C
|
CC[C@H]CC=O)NCCCC)C)[C@@H]5C=O)NCCCCCC7)))))))))))))))CNC)C
|
[C][C][C@H1][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][#Branch1][C][N][Branch1][C][C][C]
|
CC[C@@H](C4)CC2=O.N12CCC(C)(C)[C@@H]15.N13CCCCCC1.C35=O.N4(C)C
|
C[C@@]1(Nc2nccc(Br)c2C#N)C[C@@H]1C(F)(F)F
|
C[C@@]NcncccBr)c6C#N)))))))))C[C@@H]3CF)F)F
|
[C][C@@][Branch1][#C][N][C][=N][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][#N][C][C@@H1][Ring1][=N][C][Branch1][C][F][Branch1][C][F][F]
|
c14nccc(Br)c1C#N.C[C@@]13C[C@@H]15.C5(F)(F)F.N34
|
C[C@]12CSC[C@H]1CN(C(=O)CN1CCN(C(=O)Cn3cc(C#N)cn3)CC1)C2
|
C[C@]CSC[C@H]5CNC=O)CNCCNC=O)CnccC#N))cn5)))))))CC6))))))))C8
|
[C][C@][C][S][C][C@H1][Ring1][Branch1][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][N][C][=C][Branch1][Ring1][C][#N][C][=N][Ring1][#Branch1][C][C][Ring1][S][C][Ring2][Ring1][O]
|
C[C@]12CSC[C@H]1CN4C2.N16CCN5CC1.n17cc(C#N)cn1.C4(=O)C6.C5(=O)C7
|
Cn1cc2c(CN3C[C@H]4[C@H](C3)N4S(=O)(=O)c3ccc(Cl)s3)cccc2n1
|
CncccCNC[C@H][C@H]C5)N3S=O)=O)ccccCl)s5))))))))))))cccc6n9
|
[C][N][C][=C][C][Branch2][Ring1][#C][C][N][C][C@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][N][Ring1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1][=C][C][=C][C][Ring2][Ring1][=Branch1][=N][Ring2][Ring1][=Branch2]
|
Cn1cc2c7cccc2n1.S6(=O)(=O)c1ccc(Cl)s1.N15C[C@H]2[C@H](C1)N26.C57
|
C#C[C@@H]1C[C@H]2CC[C@H]1N(C(=O)C1(CNC(=O)C[C@@H]3CCC[C@H]3C)CC1)C2
|
C#C[C@@H]C[C@H]CC[C@H]6NC=O)CCNC=O)C[C@@H]CCC[C@H]5C))))))))))CC3))))C6
|
[C][#C][C@@H1][C][C@H1][C][C][C@H1][Ring1][=Branch1][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][C][C][Ring1][=C][C][Ring2][Ring1][=Branch1]
|
C#C[C@@H]1C[C@H]2CC[C@H]1N4C2.[C@@H]19CCC[C@H]1C.C178CC1.C5(=O)C9.C47=O.C68.N56
|
CO[C@H](CC1CCCC1)C(=O)N[C@@H]1CN(C(=O)c2cnn(CCF)c2)CC12CC2
|
CO[C@H]CCCCCC5))))))C=O)N[C@@H]CNC=O)ccnnCCF)))c5))))))CC5CC3
|
[C][O][C@H1][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=N][N][Branch1][Ring2][C][C][F][C][=Ring1][Branch2][C][C][Ring1][#C][C][C][Ring1][Ring1]
|
[C@@H]16CN4CC12CC2.[C@@H]5(C9)C3=O.c17cnn8c1.C19CCCC1.C47=O.C8CF.CO5.N36
|
Cc1ccnc(Cl)c1C(=O)N1CCn2cc(C(=O)NCc3ccn(C)n3)nc2C1
|
CcccncCl)c6C=O)NCCnccC=O)NCcccnC)n5))))))))nc5C9
|
[C][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][N][C][=C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][N][=C][Ring1][#C][C][Ring2][Ring1][Ring1]
|
N14CCn2cc7nc2C1.Cc1ccnc(Cl)c18.c19ccn(C)n1.C48=O.C57=O.N56.C69
|
Cc1ccccc1C1(C(=O)NC[C@@H]2CN(C(=O)Cc3cn[nH]c3)C[C@H]2O)CCC1
|
Ccccccc6CC=O)NC[C@@H]CNC=O)Cccn[nH]c5)))))))C[C@H]5O)))))))))CCC4
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=N][NH1][C][=Ring1][Branch1][C][C@H1][Ring1][=N][O][C][C][C][Ring2][Ring1][=Branch1]
|
Cc1ccccc1%10.[C@@H]18CN5C[C@H]1O.C17%10CCC1.c19cn[nH]c1.C5(=O)C9.C47=O.N46.C68
|
C=CCSCC(=O)NC[C@@H]1CC[C@@H]1NC(=O)[C@@H](O)Cc1ccc(Cl)cc1
|
C=CCSCC=O)NC[C@@H]CC[C@@H]4NC=O)[C@@H]O)CccccCl)cc6
|
[C][=C][C][S][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
c19ccc(Cl)cc1.C3(=O)[C@@H](O)C9.[C@@H]18CC[C@@H]17.C6C2=O.C=CC5.S56.N24.C48.N37
|
COC[C@H](O)C(=O)NCC1(OC)CN(C(=O)Cc2ccc3c(c2)CCO3)C1
|
COC[C@H]O)C=O)NCCOC))CNC=O)Ccccccc6)CCO5))))))))))C4
|
[C][O][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][O][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][O][Ring1][=Branch1][C][Ring2][Ring1][C]
|
c1%10ccc2c(c1)CCO2.C6[C@H](O)C4=O.C179CN5C1.C5(=O)C%10.CO6.N48.C89.O7C
|
C[C@H](C(=O)NCc1csc(C(=O)N2CCn3ncc(O)c3C2)c1)C1CCOCC1
|
C[C@H]C=O)NCccscC=O)NCCnnccO)c5C9))))))))))c5))))))))CCCOCC6
|
[C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][=C][S][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][N][N][=C][C][Branch1][C][O][=C][Ring1][=Branch1][C][Ring1][#Branch2][=C][Ring1][P][C][C][C][O][C][C][Ring1][=Branch1]
|
N15CCn2ncc(O)c2C1.c19csc7c1.C18CCOCC1.C[C@@H]8C4=O.C57=O.N46.C69
|
CCC(CC)[C@H](C)C(=O)N[C@H]1CCN(C(=O)[C@]23CSC[C@H]2C3)[C@@H]1C(C)C
|
CCCCC))[C@H]C)C=O)N[C@H]CCNC=O)[C@]CSC[C@H]5C6)))))))[C@@H]5CC)C
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@][C][S][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][C@@H1][Ring1][=N][C][Branch1][C][C][C]
|
CCC(CC)[C@H](C)C4=O.[C@H]16CCN5[C@@H]18.[C@]127CSC[C@H]1C2.C57=O.C8(C)C.N46
|
COCCC(C)(C)CNc1[nH]c(=NCc2nc(=N)[nH][nH]2)nc2c1ncn2C(C)C
|
COCCCC)C)CNc[nH]c=NCcnc=N)[nH][nH]5)))))))ncc6ncn5CC)C
|
[C][O][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][NH1][C][=Branch1][=N][=N][C][C][=N][C][=Branch1][C][=N][NH1][NH1][Ring1][=Branch1][N][=C][C][=Ring1][=C][N][=C][N][Ring1][Branch1][C][Branch1][C][C][C]
|
c15[nH]c(=NC7)nc2c1ncn26.C3CC(C)(C)C4.c17nc(=N)[nH][nH]1.C6(C)C.CO3.N45
|
C=C(C)COCC(=O)NCC[C@@](C)(CC)NC(=O)c1cccn1CCC
|
C=CC)COCC=O)NCC[C@@]C)CC))NC=O)ccccn5CCC
|
[C][=C][Branch1][C][C][C][O][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][C]
|
C6C[C@@]7(C)CC.c18cccn19.C=C(C)C4.C5C2=O.C38=O.C9CC.O45.N26.N37
|
C=CC[C@H](OC)C(=O)N(CCC(=O)NCCN(C(C)C)C(C)C)OC
|
C=CC[C@H]OC))C=O)NCCC=O)NCCNCC)C))CC)C)))))))))OC
|
[C][=C][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][C][O][C]
|
C=CC[C@H]2C(=O)N(CCC1=O)OC.C3C4.N456.C5(C)C.C6(C)C.O2C.N13
|
C[C@H](CN(C)C(=O)CCc1ccccc1C(N)=O)NC(=O)C1=NO[C@@H](C)C1
|
C[C@H]CNC)C=O)CCcccccc6CN)=O)))))))))))))NC=O)C=NO[C@@H]C)C5
|
[C][C@H1][Branch2][Ring1][=Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C][=N][O][C@@H1][Branch1][C][C][C][Ring1][=Branch1]
|
C3(=O)C1=NO[C@@H](C)C1.c17ccccc16.C2(=O)CC7.C[C@@H]4C5.N25C.C6(N)=O.N34
|
CCC12CN(C(=O)c3cnc(C)s3)C(CNC(=O)[C@@H](O)Cn3cncn3)(C1)C2
|
CCCCNC=O)ccncC)s5))))))CCNC=O)[C@@H]O)Cncncn5))))))))))C5)C5
|
[C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][S][Ring1][=Branch1][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][N][C][=N][C][=N][Ring1][Branch1][Branch1][Branch1][C][Ring2][Ring1][=Branch2][C][Ring2][Ring1][#Branch2]
|
C12%10CN4C9(C1)C2.c17cnc(C)s1.C5(=O)[C@@H](O)C8.n18cncn1.C47=O.CC%10.C69.N56
|
C#CC1(C(=O)N[C@H]2C=C[C@@H](C(=O)N3CCOC[C@@H]3CCC)C2)CCCCC1
|
C#CCC=O)N[C@H]C=C[C@@H]C=O)NCCOC[C@@H]6CCC))))))))))C5)))))))CCCCC6
|
[C][#C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@H1][C][=C][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][C][C][C][Ring1][S][C][C][C][C][C][Ring2][Ring1][=Branch2]
|
C#CC17CCCCC1.N15CCOC[C@@H]19.[C@H]16C=C[C@@H]8C1.C47=O.C58=O.C9CC.N46
|
CN1CCN(C(=O)C2CC=CC2)[C@@H](C(=O)N[C@@H]2CN(C)CC2(C)C)C1
|
CNCCNC=O)CCC=CC5))))))[C@@H]C=O)N[C@@H]CNC)CC5C)C))))))))C6
|
[C][N][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][=C][C][Ring1][Branch1][C@@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][C][C][C][C][Ring1][=Branch1][Branch1][C][C][C][C][Ring2][Ring1][Branch2]
|
CN1CCN3[C@@H]6C1.[C@@H]15CN(C)CC1(C)C.C17CC=CC1.C37=O.C46=O.N45
|
O[C@@H](Cn1cnc2c(N3CCC[C@@]4(CCO4)C3)ncnc21)c1ccoc1
|
O[C@@H]CncnccNCCC[C@@]CCO4)))C6))))))ncnc69))))))))))cccoc5
|
[O][C@@H1][Branch2][Ring1][P][C][N][C][=N][C][=C][Branch1][S][N][C][C][C][C@@][Branch1][=Branch1][C][C][O][Ring1][Ring2][C][Ring1][=Branch2][N][=C][N][=C][Ring1][#C][Ring2][Ring1][C][C][C][=C][O][C][=Ring1][Branch1]
|
n16cnc2c5ncnc21.N15CCC[C@@]2(CCO2)C1.c17ccoc1.O[C@H]7C6
|
FCC1CC(NC[C@@H]2CCC[C@H]2CF)(c2nnnn2-c2ccc(F)cc2)C1
|
FCCCCNC[C@@H]CCC[C@H]5CF)))))))))cnnnn5-ccccF)cc6)))))))))))C4
|
[F][C][C][C][C][Branch1][N][N][C][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][F][Branch2][Ring1][Ring1][C][=N][N][=N][N][Ring1][Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring1][=Branch2]
|
c18ccc(F)cc1.C15CC39C1.[C@@H]16CCC[C@H]17.c19nnnn18.FC5.N34.C46.C7F
|
C[C@H]1CC[C@H](C(=O)N2C[C@@H]3C[C@H](CCN(C(=O)c4ccccc4F)C3)C2)CC1
|
C[C@H]CC[C@H]C=O)NC[C@@H]C[C@H]CCNC=O)cccccc6F))))))))C7))))C6)))))))CC6
|
[C][C@H1][C][C][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch2][Ring1][=Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][Ring1][S][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][O]
|
N15C[C@H]2CCN6C[C@@H](C2)C1.C[C@H]1CC[C@H]7CC1.c18ccccc1F.C57=O.C68=O
|
Cc1nccc(N2C[C@@H]3C[C@]3(CNC(=O)[C@H]3CCC(=O)NC3)C2)n1
|
CcncccNC[C@@H]C[C@]3CNC=O)[C@H]CCC=O)NC6)))))))))C6))))))n6
|
[C][C][=N][C][=C][C][Branch2][Ring1][#C][N][C][C@@H1][C][C@][Ring1][Ring1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][C][Ring1][P][=N][Ring2][Ring1][#Branch1]
|
Cc1nccc6n1.N16C[C@@H]2C[C@]28C1.[C@H]17CCC(=O)NC1.C47=O.C58.N45
|
NS(=O)(=O)c1csc(CNCCc2ccc3c(c2)OCO3)c1
|
NS=O)=O)ccscCNCCcccccc6)OCO5))))))))))))c5
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][S][C][Branch2][Ring1][Ring2][C][N][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][=C][Ring2][Ring1][C]
|
NS(=O)(=O)c1csc6c1.c17ccc2c(c1)OCO2.C5C7.C46.N45
|
CCc1nc(CC(=O)NC[C@@H]2C[C@H](C)N(C(=O)CNc3cnn(C)c3)C2)cs1
|
CCcncCC=O)NC[C@@H]C[C@H]C)NC=O)CNccnnC)c5))))))))C5)))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][N][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][S][=C][S][Ring2][Ring1][#Branch2]
|
[C@@H]1%11C[C@H](C)N5C1.c19nc%10cs1.c18cnn(C)c1.C%10C4=O.C5(=O)C7.CC9.N46.C6%11.N78
|
COc1cc([C@@H](C)CC(=O)NC[C@@H]2C[C@@H](O)[C@H](NC(=O)[C@@H](C)OC)C2)ccc1C
|
COccc[C@@H]C)CC=O)NC[C@@H]C[C@@H]O)[C@H]NC=O)[C@@H]C)OC)))))C5))))))))))ccc6C
|
[C][O][C][=C][C][Branch2][Ring2][Ring1][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][C][O][C@H1][Branch1][N][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][Ring1][=N][=C][C][=C][Ring2][Ring1][#Branch2][C]
|
c16cc%10ccc1C.[C@H]19C[C@@H]8[C@H](O)C1.[C@H]%10(C)CC3=O.C4(=O)[C@H]5C.CO6.N37.C79.N48.O5C
|
C=C1CC(C)(NC(=O)[C@H](NC(=O)c2cn(CC)nn2)C2CC2)C1
|
C=CCCC)NC=O)[C@H]NC=O)ccnCC))nn5)))))))CCC3))))))C4
|
[C][=C][C][C][Branch1][C][C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][N][Branch1][Ring1][C][C][N][=N][Ring1][#Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][=Branch1]
|
C=C1CC5(C)C1.c17cn8nn1.C3(=O)[C@H]69.C47=O.C19CC1.N35.N46.C8C
|
C#CCOCC(=O)NCCCN(C)C(=O)c1cc(C)ccc1N1CCCC1=O
|
C#CCOCC=O)NCCCNC)C=O)cccC)ccc6NCCCC5=O
|
[C][#C][C][O][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][N][C][C][C][C][Ring1][Branch1][=O]
|
c18cc(C)ccc19.N19CCCC1=O.C5C2=O.C6CC7.C#CC4.N37C.C38=O.O45.N26
|
CC[C@@H]1C[C@H]1C(=O)NC1CC2(C1)CN(C(=O)[C@](C)(F)CC1CCCC1)C2
|
CC[C@@H]C[C@H]3C=O)NCCCC4)CNC=O)[C@]C)F)CCCCCC5))))))))C4
|
[C][C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][C][F][C][C][C][C][C][C][Ring1][Branch1][C][Ring1][S]
|
C15CC2(C1)CN4C2.C4(=O)[C@](C)(F)C8.C18CCCC1.[C@@H]17C[C@H]16.C36=O.CC7.N35
|
Cc1nnnn1CC(=O)NCC(=O)NCC(=O)NC[C@H]1CN2CCC1CC2
|
Ccnnnn5CC=O)NCC=O)NCC=O)NC[C@H]CNCCC6CC6
|
[C][C][=N][N][=N][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][C][N][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1]
|
[C@H]1%10CN2CCC1CC2.Cc1nnnn19.C9C3=O.C6C4=O.C7C5=O.N36.N47.N58.C8%10
|
CC[C@H](CC(=O)NC[C@@H]1[C@H]2C[C@@H]1N(C(=O)[C@@H]1CCN(C(C)=O)C1)C2)OC
|
CC[C@H]CC=O)NC[C@@H][C@H]C[C@@H]4NC=O)[C@@H]CCNCC)=O))C5))))))C5))))))))))OC
|
[C][C][C@H1][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][Ring1][Branch2][C][Ring1][#C][O][C]
|
CC[C@@H]6CC3=O.[C@@H]19[C@H]2C[C@@H]1N4C2.[C@@H]18CCN5C1.C48=O.C5(C)=O.N37.C79.O6C
|
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