SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(C)CCC(=O)C(=O)N1CCN(C(=O)C=C[C@@]2(C)CC[C@@H](C)C2(C)C)C[C@@H]1C
|
CCC)CCC=O)C=O)NCCNC=O)C=C[C@@]C)CC[C@@H]C)C5C)C)))))))))C[C@@H]6C
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C@@][Branch1][C][C][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch1][Branch1][C][C][C][C][C@@H1][Ring2][Ring1][Ring1][C]
|
C=5[C@@]1(C)CC[C@@H](C)C1(C)C.CC(C)CCC(=O)C3=O.N13CCN4C[C@@H]1C.C4(=O)C=5
|
CC(C)c1scnc1C(=O)NC[C@H](O)CCNC(=O)[C@@H]1C[C@H](C)CC[C@H]1C(C)C
|
CCC)cscnc5C=O)NC[C@H]O)CCNC=O)[C@@H]C[C@H]C)CC[C@H]6CC)C
|
[C][C][Branch1][C][C][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][C][C][C][C@H1][Ring1][#Branch1][C][Branch1][C][C][C]
|
[C@@H]17C[C@H](C)CC[C@H]19.c18scnc16.C4[C@H](O)CC5.CC8C.C26=O.C37=O.C9(C)C.N24.N35
|
C[C@H]1CCN(C(=O)c2ccc(O)cc2)C[C@H]1NC(=O)c1cc(-c2ccns2)on1
|
C[C@H]CCNC=O)ccccO)cc6)))))))C[C@H]6NC=O)ccc-cccns5)))))on5
|
[C][C@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][C@H1][Ring1][#C][N][C][=Branch1][C][=O][C][C][=C][Branch1][Branch2][C][=C][C][=N][S][Ring1][Branch1][O][N][=Ring1][#Branch2]
|
C[C@H]1CCN3C[C@H]15.c17ccc(O)cc1.c16cc8on1.c18ccns1.C37=O.C46=O.N45
|
C[C@H]1CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H]2CCCOC2)C2(O)CCC2)CC1
|
C[C@H]CC[C@H]NC=O)[C@@H]NC=O)C[C@H]CCCOC6)))))))))CO)CCC4)))))))CC6
|
[C][C@H1][C][C][C@H1][Branch2][Ring1][S][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][C][Ring2][Ring1][=Branch2]
|
C[C@H]1CC[C@H]6CC1.[C@H]18CCCOC1.C3(=O)[C@@H]57.C17(O)CCC1.C4(=O)C8.N36.N45
|
CSCCNC(=O)[C@@H](c1ccccn1)N1CCC[C@H]1c1cnn(C)c1
|
CSCCNC=O)[C@@H]cccccn6))))))NCCC[C@H]5ccnnC)c5
|
[C][S][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][N][C][C][C][C@H1][Ring1][Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
c16ccccn1.N14CCC[C@H]17.c17cnn(C)c1.C2(=O)[C@H]46.C5C3.CS5.N23
|
CN(C)C(=O)[C@H]1CCCC[C@@H]1NC(=O)N1CCN(Cc2cccs2)CC1
|
CNC)C=O)[C@H]CCCC[C@@H]6NC=O)NCCNCccccs5))))))CC6
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C][N][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][N]
|
[C@H]18CCCC[C@@H]17.N15CCN6CC1.c19cccs1.CN3C.C38=O.C45=O.N47.C69
|
CCN1C(=O)CC[C@H]1C(=O)NC1(CNC(=O)C2=CCCC2(C)C)CC1
|
CCNC=O)CC[C@H]5C=O)NCCNC=O)C=CCCC5C)C)))))))))CC3
|
[C][C][N][C][=Branch1][C][=O][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Branch1][Branch1][C][C][C][C][C][Ring1][=C]
|
C4(=O)C1=CCCC1(C)C.N18C(=O)CC[C@H]17.C159CC1.C37=O.CC8.N35.C69.N46
|
O=C(NC[C@H](NC(=O)[C@@H]1CCOC1=O)C1CCC1)c1cn2c(n1)CCCC2
|
O=CNC[C@H]NC=O)[C@@H]CCOC5=O))))))))CCCC4)))))))ccncn5)CCCC6
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C@@H1][C][C][O][C][Ring1][Branch1][=O][C][C][C][C][Ring1][Ring2][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C][C][C][Ring1][#Branch1]
|
c17cn2c(n1)CCCC2.[C@@H]18CCOC1=O.C5[C@H]69.C19CCC1.O=C37.C48=O.N35.N46
|
CSCC(=O)N1[C@@H]2CC[C@H]1[C@H](F)[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)C2
|
CSCC=O)N[C@@H]CC[C@H]5[C@H]F)[C@@H]NC=O)CCccccCC)C)C))cc6))))))))))C7
|
[C][S][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C@H1][Branch1][C][F][C@@H1][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][Ring2][Ring1][#Branch1]
|
N13[C@@H]2CC[C@H]1[C@H](F)[C@@H]6C2.c17ccc8cc1.C4(=O)CC7.C5C3=O.C8(C)(C)C.CS5.N46
|
CCc1c[nH]nc1C(=O)N[C@H](C)CCCNC(=O)CNC(=O)c1ccc(F)cc1
|
CCcc[nH]nc5C=O)N[C@H]C)CCCNC=O)CNC=O)ccccF)cc6
|
[C][C][C][=C][NH1][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
c19ccc(F)cc1.c1%10c[nH]nc18.[C@@H]5(C)CCC6.C3(=O)C7.C28=O.C49=O.CC%10.N25.N36.N47
|
CC=CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1onc(OC)c1Br)C[C@H](C)O2
|
CC=CC=O)NCC[C@@]C5)CNC=O)concOC))c5Br)))))))C[C@H]C)O6
|
[C][C][=C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][O][N][=C][Branch1][Ring1][O][C][C][=Ring1][#Branch1][Br][C][C@H1][Branch1][C][C][O][Ring2][Ring1][C]
|
N13CC[C@@]2(C1)CN4C[C@H](C)O2.c16onc5c1Br.C=7C3=O.C46=O.CC=7.O5C
|
CSC1=C(C(=O)N(C)CCNC(=O)c2ccc3nnc(C)n3c2)CCCC1
|
CSC=CC=O)NC)CCNC=O)ccccnncC)n5c9)))))))))))))))CCCC6
|
[C][S][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=N][N][=C][Branch1][C][C][N][Ring1][=Branch1][C][=Ring1][#Branch2][C][C][C][C][Ring2][Ring1][=Branch2]
|
CSC1=C(C4=O)CCCC1.c18ccc2nnc(C)n2c1.N46C.C6C7.C58=O.N57
|
C#Cc1cncc(CNc2cnn(C(=O)OC(C)(C)C)c2)c1
|
C#CccnccCNccnnC=O)OCC)C)C))))c5)))))))c6
|
[C][#C][C][=C][N][=C][C][Branch2][Ring1][=Branch2][C][N][C][C][=N][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][N][=C][Ring2][Ring1][Ring2]
|
C#Cc1cncc7c1.c16cnn(C3=O)c1.C4(C)(C)C.C57.N56.O34
|
C[C@H](NC(=O)C1=C[C@]2(CCOC2)C1)c1nocc1C(=O)N1CC([N+](=O)[O-])C1
|
C[C@H]NC=O)C=C[C@]CCOC5))))C4))))))cnocc5C=O)NCC[N+]=O)[O-]))C4
|
[C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C@][Branch1][#Branch1][C][C][O][C][Ring1][Branch1][C][Ring1][Branch2][C][=N][O][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Ring1][#Branch1]
|
C3(=O)C1=C[C@]2(CCOC2)C1.N14CC([N+](=O)[O-])C1.c17nocc16.C[C@H]57.C46=O.N35
|
C[C@@H]1CN(C)[C@H](C)C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H]1CC1(Cl)Cl)c1cnn(C)c1
|
C[C@@H]CNC)[C@H]C)C[C@@H]6NC=O)[C@@H]NC=O)[C@H]CC3Cl)Cl))))))ccnnC)c5
|
[C][C@@H1][C][N][Branch1][C][C][C@H1][Branch1][C][C][C][C@@H1][Ring1][Branch2][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][Branch1][C][Cl][Cl][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
C[C@@H]1CN(C)[C@H](C)C[C@@H]15.c17cnn(C)c1.C2(=O)[C@@H]47.[C@H]16CC1(Cl)Cl.C36=O.N25.N34
|
C[C@@H](NC(=O)c1n[nH]c2c1COCC2)[C@@H](CO)NC(=O)[C@@H](C1CC1)N1CCCC1
|
C[C@@H]NC=O)cn[nH]cc5COCC6)))))))))))[C@@H]CO))NC=O)[C@@H]CCC3)))NCCCC5
|
[C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][O][C][C][Ring1][=Branch1][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][C][C][C][C][Ring1][Branch1]
|
c18n[nH]c2c1COCC2.C[C@@H]5[C@H]6CO.C4(=O)[C@H]79.N17CCCC1.C38=O.C19CC1.N35.N46
|
CO[C@@H](CNCc1ccnn1C1CCCCC1)[C@@H]1CCCOC1
|
CO[C@@H]CNCcccnn5CCCCCC6))))))))))))))[C@@H]CCCOC6
|
[C][O][C@@H1][Branch2][Ring1][Ring1][C][N][C][C][=C][C][=N][N][Ring1][Branch1][C][C][C][C][C][C][Ring1][=Branch1][C@@H1][C][C][C][O][C][Ring1][=Branch1]
|
c15ccnn17.C17CCCCC1.[C@@H]16CCCOC1.[C@@H]26C3.CO2.N34.C45
|
C#CCCC[C@H](C(=O)NCc1nnn(C)n1)N(C)[C@@H]1CCC[C@H](C)C1
|
C#CCCC[C@H]C=O)NCcnnnC)n5))))))))NC)[C@@H]CCC[C@H]C)C6
|
[C][#C][C][C][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][N][=N][N][Branch1][C][C][N][=Ring1][=Branch1][N][Branch1][C][C][C@@H1][C][C][C][C@H1][Branch1][C][C][C][Ring1][#Branch1]
|
C#CCCC[C@@H]3C2=O.[C@@H]15CCC[C@H](C)C1.c16nnn(C)n1.N35C.N24.C46
|
C[C@H]1C[C@H]1C(=O)N[C@H]1CCO[C@H]1C(=O)NCC(C)(C)C(F)F
|
C[C@H]C[C@H]3C=O)N[C@H]CCO[C@H]5C=O)NCCC)C)CF)F
|
[C][C@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][C][C][O][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][F]
|
C4C(C)(C)C(F)F.[C@H]15CCO[C@H]16.C[C@H]1C[C@H]17.C27=O.C36=O.N25.N34
|
CC(C)(C)OC(=O)C12CC(C(=O)N3CC[C@@H]4[C@H]3C[C@H]4OC(C)(C)C)(CO1)C2
|
CCC)C)OC=O)CCCC=O)NCC[C@@H][C@H]5C[C@H]4OCC)C)C)))))))))))CO5))C4
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][C@@H1][C@H1][Ring1][Branch1][C][C@H1][Ring1][Ring2][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][=Branch1][C][O][Ring2][Ring1][Ring1][C][Ring2][Ring1][Ring2]
|
N16CC[C@H]2[C@H]9C[C@H]21.C12%10CC%11(CO1)C2.CC7(C)C.C8(C)(C)C.C5%10=O.C6%11=O.O57.O89
|
Cc1sccc1C(=O)N(C)CC(C)(C)NC(=O)[C@@H](C)NC(=O)C1CC1
|
Ccsccc5C=O)NC)CCC)C)NC=O)[C@@H]C)NC=O)CCC3
|
[C][C][S][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1]
|
Cc1sccc19.C5C6(C)C.C3(=O)[C@H]7C.C29=O.N25C.C48=O.C18CC1.N36.N47
|
CN(C[C@@H]1CCN(C(=O)C=C2CN3CCC2CC3)C1)C(=O)[C@@H]1COC(=O)N1C
|
CNC[C@@H]CCNC=O)C=CCNCCC6CC6))))))))))C5))))))C=O)[C@@H]COC=O)N5C
|
[C][N][Branch2][Ring1][=N][C][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][N][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1][C][Ring1][S][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C]
|
C1=8CN2CCC1CC2.[C@@H]17COC(=O)N1C.[C@@H]19CCN4C1.C4(=O)C=8.CN56.C57=O.C69
|
N#Cc1ccc(C(=O)N2CC(CNC(=O)CNC(=O)c3ccco3)C2)[nH]1
|
N#CccccC=O)NCCCNC=O)CNC=O)cccco5)))))))))))C4)))))[nH]5
|
[N][#C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][P][NH1][Ring2][Ring1][Branch2]
|
N#Cc1ccc9[nH]1.N14CC%11C1.c1%10ccco1.C5(=O)C8.C49=O.C6%10=O.C7%11.N57.N68
|
CCOc1ccc(CN[C@@H]2CCS(=O)(=O)[C@@H](C)C2)c(Cl)c1
|
CCOccccCN[C@@H]CCS=O)=O)[C@@H]C)C6))))))))cCl)c6
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][Ring2][C][N][C@@H1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
|
[C@@H]16CCS(=O)(=O)[C@@H](C)C1.c14ccc7c(Cl)c1.CC3.O34.C57.N56
|
CO[C@@H]1COCC[C@H]1CC(=O)NCC(C)(C)OCCNC(=O)C1(F)CC1
|
CO[C@@H]COCC[C@H]6CC=O)NCCC)C)OCCNC=O)CF)CC3
|
[C][O][C@@H1][C][O][C][C][C@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][O][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][C][C][Ring1][Ring2]
|
[C@@H]16COCC[C@H]1%10.C7C4(C)C.C%10C2=O.C19(F)CC1.C5C8.C39=O.CO6.N27.O45.N38
|
Cc1sc(C(F)(F)F)nc1C(=O)NCC#CCNC(=O)[C@@H](C)O
|
CcscCF)F)F))nc5C=O)NCC#CCNC=O)[C@@H]C)O
|
[C][C][S][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][=Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][#C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O]
|
Cc1sc7nc16.C4C#CC5.C3(=O)[C@@H](C)O.C7(F)(F)F.C26=O.N24.N35
|
Cc1cc(C)c(C(=O)N(C)CC2(O)CN(C(=O)[C@@H](O)CCC(C)C)C2)cn1
|
CcccC)cC=O)NC)CCO)CNC=O)[C@@H]O)CCCC)C))))))C4)))))))cn6
|
[C][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][O][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][Branch1][C][C][C][C][Ring1][=C][C][=N][Ring2][Ring1][#Branch2]
|
C4(=O)[C@@H](O)CCC(C)C.Cc1cc(C)c6cn1.C17(O)CN4C1.C36=O.N35C.C57
|
O=C(N[C@@H]1CCN(C(=O)c2cnc3n2CCC3)C[C@H]1O)[C@@H]1C[C@H]2CC[C@@H](C1)[C@@H]2O
|
O=CN[C@@H]CCNC=O)ccncn5CCC5)))))))))C[C@H]6O))))))))[C@@H]C[C@H]CC[C@@H]C7)[C@@H]5O
|
[O][=C][Branch2][Ring1][=N][N][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][C][C][Ring1][Branch1][C][C@H1][Ring1][S][O][C@@H1][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][C@@H1][Ring1][=Branch1][O]
|
[C@@H]18C[C@H]2CC[C@@H](C1)[C@@H]2O.[C@@H]16CCN5C[C@H]1O.c17cnc2n1CCC2.O=C48.C57=O.N46
|
O=C([C@@H](F)CC1CC1)N1CCCC2(C1)CN(C(=O)C(F)(F)c1cccc(Cl)c1)C2
|
O=C[C@@H]F)CCCC3)))))NCCCCC6)CNC=O)CF)F)cccccCl)c6))))))))C4
|
[O][=C][Branch1][O][C@@H1][Branch1][C][F][C][C][C][C][Ring1][Ring1][N][C][C][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][Ring1][P]
|
N13CCCC2(C1)CN4C2.c16cccc(Cl)c1.O=C3[C@@H](F)C5.C4(=O)C6(F)F.C15CC1
|
CCc1ccc(CC(=O)NC[C@H]2C[C@@H](NC(=O)Cc3ccc(C)nc3)C2)cc1F
|
CCccccCC=O)NC[C@H]C[C@@H]NC=O)CccccC)nc6)))))))))C4))))))))cc6F
|
[C][C][C][=C][C][=C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C][Ring1][#C][C][=C][Ring2][Ring1][#Branch2][F]
|
c19ccc%10cc1F.c1%11ccc(C)nc1.[C@H]18C[C@@H]7C1.C%10C4=O.C5(=O)C%11.CC9.N46.C68.N57
|
C[C@@]1(c2ccccc2)CCCCN1C(=O)C(=O)N[C@@H]1CC[C@H](C#N)C1
|
C[C@@]cccccc6))))))CCCCN6C=O)C=O)N[C@@H]CC[C@H]C#N))C5
|
[C][C@@][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][N][Ring1][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][Ring1][C][#N][C][Ring1][#Branch1]
|
C[C@@]16CCCCN13.[C@@H]15CC[C@H](C#N)C1.c16ccccc1.C3(=O)C4=O.N45
|
COc1ccc(Cl)c(C(=O)N2CCN(C(=O)c3cc(N)nc(Cl)c3)[C@@H]3C[C@H]32)n1
|
COccccCl)cC=O)NCCNC=O)cccN)ncCl)c6)))))))[C@@H]C[C@H]37))))))))n6
|
[C][O][C][=C][C][=C][Branch1][C][Cl][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][N][=N][C][Branch1][C][Cl][=C][Ring1][Branch2][C@@H1][C][C@H1][Ring1][Ring1][Ring1][P][=N][Ring2][Ring1][#Branch2]
|
c16ccc(Cl)c7n1.N14CCN5[C@@H]2C[C@H]21.c18cc(N)nc(Cl)c1.C47=O.C58=O.CO6
|
N#Cc1ncc(C(=O)N2C[C@H](NC(=O)C3(CCO)CC3)CC23CCC3)s1
|
N#CcnccC=O)NC[C@H]NC=O)CCCO)))CC3)))))CC5CCC4)))))))))s5
|
[N][#C][C][=N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][Branch1][Ring2][C][C][O][C][C][Ring1][=Branch1][C][C][Ring1][=C][C][C][C][Ring1][Ring2][S][Ring2][Ring1][Branch2]
|
N14C[C@H]6CC12CCC2.N#Cc1ncc7s1.C189CC1.C47=O.C58=O.C9CO.N56
|
C[C@](Cn1cccn1)(NC(=O)c1nn(-c2ccccc2)c2c1CCCC2)C(=O)O
|
C[C@]Cncccn5))))))NC=O)cnn-cccccc6))))))cc5CCCC6)))))))))))C=O)O
|
[C][C@][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][O][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][O]
|
c15nn7c2c1CCCC2.C[C@@]4(C6)C(=O)O.c17ccccc1.n16cccn1.C35=O.N34
|
CC(C)c1ncc(C(=O)N[C@@H](C(=O)NCC(C)(C)C#N)c2cccs2)o1
|
CCC)cnccC=O)N[C@@H]C=O)NCCC)C)C#N))))))ccccs5))))))))o5
|
[C][C][Branch1][C][C][C][=N][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][#N][C][=C][C][=C][S][Ring1][Branch1][O][Ring2][Ring1][#Branch1]
|
c18ncc7o1.C6C(C)(C)C#N.[C@@H]59C4=O.c19cccs1.CC8C.C37=O.N35.N46
|
CCCC[C@H](CC)CC(=O)NCC[C@@H]1CN(C(=O)[C@H]2CC(=O)[C@@H]2C)CCCO1
|
CCCC[C@H]CC))CC=O)NCC[C@@H]CNC=O)[C@H]CC=O)[C@@H]4C))))))CCCO7
|
[C][C][C][C][C@H1][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C][=Branch1][C][=O][C@@H1][Ring1][Branch1][C][C][C][C][O][Ring1][#C]
|
CCCC[C@H](CC)CC3=O.[C@@H]17CN4CCCO1.[C@H]16CC(=O)[C@@H]1C.C5C7.C46=O.N35
|
O=C(CCCn1cccc1)NCCC[C@H](O)C(=O)N1CCC[C@](F)(CO)C1
|
O=CCCCncccc5))))))))NCCC[C@H]O)C=O)NCCC[C@]F)CO))C6
|
[O][=C][Branch1][O][C][C][C][N][C][=C][C][=C][Ring1][Branch1][N][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][F][Branch1][Ring1][C][O][C][Ring1][=Branch2]
|
C4CC[C@H](O)C3=O.N13CCC[C@@]6(F)C1.O=C2CCC5.n15cccc1.N24.C6O
|
C#CCSCC(=O)NC[C@H](Cc1ccccc1)NC(=O)c1cocc1C
|
C#CCSCC=O)NC[C@H]Ccccccc6)))))))NC=O)ccocc5C
|
[C][#C][C][S][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][C]
|
c19ccccc1.c18cocc1C.C4[C@@H]5C9.C7C2=O.C#CC6.C38=O.S67.N24.N35
|
C[C@@H](NC(=O)[C@H]1CCOC1)C1CC(NC(=O)CCc2ccncc2)C1
|
C[C@@H]NC=O)[C@H]CCOC5)))))))CCCNC=O)CCcccncc6))))))))))C4
|
[C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][C][O][C][Ring1][Branch1][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring1][#C]
|
c19ccncc1.[C@H]17CCOC1.C18CC6C1.C4(=O)CC9.C[C@@H]58.C37=O.N35.N46
|
C#CC[C@@]1(C(=O)N2CCC(CNC(=O)[C@H]3C[C@](O)(CC#C)C3)CC2)CCCOC1
|
C#CC[C@@]C=O)NCCCCNC=O)[C@H]C[C@]O)CC#C)))C4)))))))CC6)))))))CCCOC6
|
[C][#C][C][C@@][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C@][Branch1][C][O][Branch1][Ring2][C][C][#C][C][Ring1][Branch2][C][C][Ring2][Ring1][C][C][C][C][O][C][Ring2][Ring1][#Branch2]
|
[C@@]179CCCOC1.N14CCC%10CC1.[C@H]18C[C@@]%11(O)C1.C#CC9.C47=O.C58=O.C%11C#C.C6%10.N56
|
Cc1cccc(C(F)(F)C(=O)N[C@H]2CN(C(=O)c3csnn3)CC[C@@H]2C)c1
|
CcccccCF)F)C=O)N[C@H]CNC=O)ccsnn5))))))CC[C@@H]6C))))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Ring1][C][Branch1][C][F][Branch1][C][F][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][S][N][=N][Ring1][Branch1][C][C][C@@H1][Ring1][=N][C][=C][Ring2][Ring1][#Branch2]
|
[C@H]16CN5CC[C@@H]1C.Cc1cccc8c1.C8(F)(F)C4=O.c17csnn1.C57=O.N46
|
CC(C)OC(C)(C)CN[C@H](C)c1ccc(C(=O)O)cn1
|
CCC)OCC)C)CN[C@H]C)ccccC=O)O))cn6
|
[C][C][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][N][C@H1][Branch1][C][C][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=N][Ring1][=Branch2]
|
c17ccc6cn1.C3(C)(C)C4.CC2C.[C@H]57C.C6(=O)O.O23.N45
|
CCCc1nc(C)c(C(=O)N(CC)[C@@H](C)CNC(=O)CN(C)C2CC2)s1
|
CCCcncC)cC=O)NCC))[C@@H]C)CNC=O)CNC)CCC3)))))))))))s5
|
[C][C][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][C][Ring1][Ring1][S][Ring2][Ring1][#Branch1]
|
c1%11nc(C)c%10s1.[C@H]6(C)C7.C4(=O)C8.CCC%11.C3%10=O.N356.N89C.C19CC1.C5C.N47
|
C[C@@H](NC(=O)c1ccc(Br)cc1)C(=O)NC[C@H]1CCOC1=O
|
C[C@@H]NC=O)ccccBr)cc6))))))))C=O)NC[C@H]CCOC5=O
|
[C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][O][C][Ring1][Branch1][=O]
|
c16ccc(Br)cc1.[C@H]17CCOC1=O.C[C@@H]4C3=O.C26=O.N24.N35.C57
|
Cc1cc(C(=O)N2CC[C@@H](NC(=O)[C@@H]3C[C@@H]3C(F)F)[C@@H]2C2CC2)c(N)c(Cl)n1
|
CcccC=O)NCC[C@@H]NC=O)[C@@H]C[C@@H]3CF)F)))))))[C@@H]5CCC3)))))))))cN)cCl)n6
|
[C][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][Branch1][C][F][F][C@@H1][Ring1][=C][C][C][C][Ring1][Ring1][=C][Branch1][C][N][C][Branch1][C][Cl][=N][Ring2][Ring1][O]
|
Cc1cc8c(N)c(Cl)n1.N14CC[C@@H]6[C@@H]1%10.[C@@H]17C[C@@H]19.C48=O.C57=O.C9(F)F.C1%10CC1.N56
|
C[C@@H](CNC(=O)[C@@H]1CC[C@H](NC(=O)Cn2nccn2)C1)N(C)C
|
C[C@@H]CNC=O)[C@@H]CC[C@H]NC=O)Cnnccn5))))))))C5))))))))NC)C
|
[C][C@@H1][Branch2][Ring1][=N][C][N][C][=Branch1][C][=O][C@@H1][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][N][N][=C][C][=N][Ring1][Branch1][C][Ring1][=C][N][Branch1][C][C][C]
|
[C@@H]18CC[C@H]7C1.n19nccn1.C[C@H]5C6.C4(=O)C9.C38=O.N5(C)C.N36.N47
|
Cc1cccn2c(CC(=O)NC[C@@H](C)Nc3cc4nnc(C)n4cn3)cnc12
|
CccccncCC=O)NC[C@@H]C)NcccnncC)n5cn9)))))))))))))))cnc95
|
[C][C][=C][C][=C][N][C][Branch2][Ring1][=N][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][C][=C][C][=N][N][=C][Branch1][C][C][N][Ring1][=Branch1][C][=N][Ring1][#Branch2][=C][N][=C][Ring2][Ring1][O][Ring2][Ring1][#Branch1]
|
Cc1cccn2c9cnc12.c18cc2nnc(C)n2cn1.C9C5=O.C6[C@H]7C.N56.N78
|
CCN(CC(C)(C)CN)C(=O)C[C@H](N)Cc1ccc(OC)cc1
|
CCNCCC)C)CN))))C=O)C[C@H]N)CccccOC))cc6
|
[C][C][N][Branch1][O][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][N][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2]
|
C2(=O)C[C@H](N)C6.c16ccc3cc1.C5C(C)(C)CN.N245.CC4.O3C
|
C#Cc1cccc(C(=O)N[C@H](Cc2cn[nH]c2)C(=O)NCC2(O)CC2)c1
|
C#CcccccC=O)N[C@H]Cccn[nH]c5))))))C=O)NCCO)CC3)))))))))c6
|
[C][#C][C][=C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch2][C][C][C][=N][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][C][Ring1][Ring2][=C][Ring2][Ring1][Branch2]
|
C#Cc1cccc7c1.[C@@H]5(C9)C4=O.c19cn[nH]c1.C18(O)CC1.C37=O.N35.N46.C68
|
CCn1ccc(C(=O)N[C@]2(C)C[C@H](NC(=O)[C@@H](CC3CCCC3)OC)C2)n1
|
CCncccC=O)N[C@]C)C[C@H]NC=O)[C@@H]CCCCCC5))))))OC)))))C4))))))n5
|
[C][C][N][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Branch1][O][C][C][Ring1][P][=N][Ring2][Ring1][=Branch2]
|
n1%10ccc9n1.[C@]17(C)C[C@@H]8C1.C5(=O)[C@H]6C%11.C1%11CCCC1.C49=O.CC%10.N47.N58.O6C
|
COC(C)(C)C(=O)N1CCC[C@]1(C)C(=O)N1C[C@H](O)CC1(C)C
|
COCC)C)C=O)NCCC[C@]5C)C=O)NC[C@H]O)CC5C)C
|
[C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C][Ring1][=Branch1][Branch1][C][C][C]
|
N13C[C@H](O)CC1(C)C.N12CCC[C@@]15C.C4(C)(C)C2=O.C35=O.CO4
|
C[C@H]1CC(C(=O)NC[C@@](C)(CO)NC(=O)c2cnc3[nH]c(=N)sc3c2)=NO1
|
C[C@H]CCC=O)NC[C@@]C)CO))NC=O)ccnc[nH]c=N)sc5c9)))))))))))))))=NO5
|
[C][C@H1][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][N][=C][NH1][C][=Branch1][C][=N][S][C][Ring1][=Branch1][=C][Ring1][#Branch2][=N][O][Ring2][Ring1][#Branch2]
|
c18cnc2[nH]c(=N)sc2c1.C[C@H]1CC(C4=O)=NO1.C6[C@@]7(C)CO.C58=O.N46.N57
|
CNC(=O)C(=O)N1C[C@@H]2COC[C@]2(C(=O)NCCNC(=O)c2cccnc2)C1
|
CNC=O)C=O)NC[C@@H]COC[C@]5C=O)NCCNC=O)ccccnc6))))))))))))C8
|
[C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C@][Ring1][Branch1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
N14C[C@@H]2COC[C@]29C1.c1%10cccnc1.C3(=O)C4=O.C59=O.C7C8.C6%10=O.CN3.N57.N68
|
CC(=CC(=O)N1CC[C@H]2C[C@]21C(=O)N(C)CCCO)C(C)C
|
CC=CC=O)NCC[C@H]C[C@]36C=O)NC)CCCO))))))))))))))CC)C
|
[C][C][=Branch2][Ring1][N][=C][C][=Branch1][C][=O][N][C][C][C@H1][C][C@][Ring1][Ring1][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][O][C][Branch1][C][C][C]
|
N13CC[C@H]2C[C@]216.CC=7C(C)C.C=7C3=O.C5CCO.C46=O.N45C
|
C[C@@H]1C[C@H](CNC(=O)CC2CCN(C)CC2)CN(C(=O)C[C@@H](C)C2CC2)C1
|
C[C@@H]C[C@H]CNC=O)CCCCNC)CC6))))))))))CNC=O)C[C@@H]C)CCC3))))))C6
|
[C][C@@H1][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring2][Ring1][#Branch2]
|
C[C@@H]1C[C@H]6CN4C1.C17CCN(C)CC1.C4(=O)C[C@H]8C.C3(=O)C7.C18CC1.C56.N35
|
CCN(CC(C)C)[C@@H]1CCCCN(C(=O)C[C@@H]2CCCO2)C1=O
|
CCNCCC)C)))[C@@H]CCCCNC=O)C[C@@H]CCCO5)))))))C7=O
|
[C][C][N][Branch1][#Branch1][C][C][Branch1][C][C][C][C@@H1][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C@@H1][C][C][C][O][Ring1][Branch1][C][Ring1][#C][=O]
|
[C@@H]16CCCCN3C1=O.[C@@H]17CCCO1.C5C(C)C.C3(=O)C7.N456.CC4
|
COC(=O)c1ccc2c(COC(=O)c3oc(C(=O)OC)cc3C)csc2c1
|
COC=O)cccccCOC=O)cocC=O)OC)))cc5C)))))))))csc5c9
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][#Branch1][C][O][C][=Branch1][C][=O][C][O][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][=Ring1][=Branch2][C][=C][S][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][#Branch1]
|
c1%10ccc2c%11csc2c1.c18oc9cc1C.C4%10=O.C58=O.C69=O.CO4.C7%11.O57.O6C
|
CC1=C(C(=O)N2CC[C@H]3CN(C(=O)c4ccc(N)c(F)n4)C[C@H]32)CCO1
|
CC=CC=O)NCC[C@H]CNC=O)ccccN)cF)n6)))))))C[C@H]58)))))))))CCO5
|
[C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][Branch1][C][F][=N][Ring1][Branch2][C][C@H1][Ring1][#C][Ring2][Ring1][C][C][C][O][Ring2][Ring1][=Branch2]
|
N15CC[C@H]2CN6C[C@H]21.CC1=C(C5=O)CCO1.c17ccc(N)c(F)n1.C67=O
|
Cc1nocc1C(=O)N[C@@H]1[C@H]2C[C@@H]1N(C(=O)CNC(=O)c1cccc(Br)c1)C2
|
Ccnocc5C=O)N[C@@H][C@H]C[C@@H]4NC=O)CNC=O)cccccBr)c6))))))))))C5
|
[C][C][=N][O][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][Ring2][Ring1][C]
|
[C@@H]17[C@H]2C[C@@H]1N4C2.c19cccc(Br)c1.Cc1nocc18.C4(=O)C6.C38=O.C59=O.N37.N56
|
CN(C)[C@@H]1CN(C(=O)Cc2c[nH]nc2O)C[C@H]1CNC(=O)[C@@]12C=C[C@@H](CC1)C2
|
CNC)[C@@H]CNC=O)Ccc[nH]nc5O))))))))C[C@H]5CNC=O)[C@@]C=C[C@@H]CC6))C5
|
[C][N][Branch1][C][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][=C][NH1][N][=C][Ring1][Branch1][O][C][C@H1][Ring1][=C][C][N][C][=Branch1][C][=O][C@@][C][=C][C@@H1][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1]
|
[C@@H]16CN3C[C@H]18.[C@@]127C=C[C@@H](CC1)C2.c19c[nH]nc1O.C3(=O)C9.CN6C.C47=O.C58.N45
|
CCCn1nnnc1C1(NC[C@@](C)(CO)OC)CCN(CCO)CC1
|
CCCnnnnc5CNC[C@@]C)CO))OC)))))CCNCCO)))CC6
|
[C][C][C][N][N][=N][N][=C][Ring1][Branch1][C][Branch1][=N][N][C][C@@][Branch1][C][C][Branch1][Ring1][C][O][O][C][C][C][N][Branch1][Ring2][C][C][O][C][C][Ring1][P]
|
C137CCN5CC1.n16nnnc17.C4[C@@]2(C)CO.CCC6.C5CO.N34.O2C
|
CCn1cc(NC(=O)[C@H]2CC23CN(S(=O)(=O)c2ccc(OC)nc2)C3)nn1
|
CCnccNC=O)[C@H]CC3CNS=O)=O)ccccOC))nc6)))))))C4))))))))nn5
|
[C][C][N][C][=C][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][N][Branch2][Ring1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][N][=C][Ring1][Branch2][C][Ring1][#C][N][=N][Ring2][Ring1][=Branch2]
|
S6(=O)(=O)c1ccc5nc1.[C@H]18CC12CN6C2.n19cc7nn1.C48=O.CC9.N47.O5C
|
CCOC1(C(=O)NC[C@H](CC(C)C)C(=O)N2CC[C@@](C)(N(C)C)C2)CCCC1
|
CCOCC=O)NC[C@H]CCC)C)))C=O)NCC[C@@]C)NC)C))C5))))))))))CCCC5
|
[C][C][O][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][=Branch2][C][C][C][C][Ring2][Ring1][=Branch2]
|
C7[C@H](CC(C)C)C4=O.N14CC[C@]8(C)C1.C169CCCC1.C39=O.N8(C)C.CC5.O56.N37
|
Cc1c(C(=O)N[C@H]2C[C@@H](CCNC(=O)C3(C)CCCC3)C2)nc2sccn12
|
CccC=O)N[C@H]C[C@@H]CCNC=O)CC)CCCC5)))))))))C4))))))ncsccn85
|
[C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][C][C][Ring1][=Branch1][C][Ring1][#C][N][=C][S][C][=C][N][Ring2][Ring1][#Branch2][Ring1][Branch1]
|
Cc1c8nc2sccn12.C19(C)CCCC1.[C@H]17C[C@@H]%10C1.C48=O.C%10C6.C59=O.N47.N56
|
C[C@H]1[C@@H](NC(=O)[C@H]2CN(C(=O)CCN(C)CCO)CCN2C)C1(C)C
|
C[C@H][C@@H]NC=O)[C@H]CNC=O)CCNC)CCO)))))))CCN6C)))))))))C3C)C
|
[C][C@H1][C@@H1][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][Branch1][C][C][C][C][O][C][C][N][Ring1][#C][C][C][Ring2][Ring1][=Branch1][Branch1][C][C][C]
|
[C@H]18CN4CCN1C.C[C@H]1[C@@H]7C1(C)C.C4(=O)CC5.C38=O.N56C.C6CO.N37
|
CCCCC[C@H](C)C(=O)N1[C@H]2C[C@H]1CN(C(=O)[C@@H](CCC)NC(C)=O)C2
|
CCCCC[C@H]C)C=O)N[C@H]C[C@H]4CNC=O)[C@@H]CCC)))NCC)=O)))))C6
|
[C][C][C][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Ring1][Ring2][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][Ring2][C][C][C][N][C][Branch1][C][C][=O][C][Ring1][S]
|
CCCCC[C@H](C)C3=O.N13[C@H]2C[C@H]1CN4C2.C4(=O)[C@H]6CCC.C5(C)=O.N56
|
CC(C)(C)[C@@H](O)c1cn(CC(=O)NC[C@H](CO)Cc2ccc(F)c(F)c2)nn1
|
CCC)C)[C@@H]O)ccnCC=O)NC[C@H]CO))CccccF)cF)c6))))))))))))nn5
|
[C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][C][O][C][=C][N][Branch2][Ring1][N][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][C][O][C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][N][=N][Ring2][Ring1][=Branch1]
|
c17ccc(F)c(F)c1.CC(C)(C)[C@H]6O.c16cn5nn1.C4[C@@H](C7)CO.C5C3=O.N34
|
C[C@@H](C(=O)N[C@@H]1CCCCN(C(=O)Cc2cocn2)C1)n1cc(Cl)cn1
|
C[C@@H]C=O)N[C@@H]CCCCNC=O)Cccocn5)))))))C7)))))))))nccCl)cn5
|
[C][C@@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][O][C][=N][Ring1][Branch1][C][Ring1][#C][N][C][=C][Branch1][C][Cl][C][=N][Ring1][=Branch1]
|
[C@@H]15CCCCN4C1.n16cc(Cl)cn1.C[C@H]6C3=O.c17cocn1.C4(=O)C7.N35
|
Cn1cc(C(N)=O)cc1C(=O)N1C[C@H](O)[C@H](NC(=O)Cc2c(F)cccc2Cl)C1
|
CnccCN)=O))cc5C=O)NC[C@H]O)[C@H]NC=O)CccF)cccc6Cl))))))))))C5
|
[C][N][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][Cl][C][Ring2][Ring1][C]
|
c18c(F)cccc1Cl.Cn1cc7cc16.N13C[C@@H]5[C@@H](O)C1.C4(=O)C8.C7(N)=O.C36=O.N45
|
C[C@H](CNC(=O)c1cncc(-n2cccn2)n1)N(C)C(=O)c1cc(Cl)cn1C
|
C[C@H]CNC=O)ccncc-ncccn5)))))n6)))))))))NC)C=O)cccCl)cn5C
|
[C][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][=N][Ring1][O][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][N][Ring1][=Branch1][C]
|
c17cncc9n1.c18cc(Cl)cn1C.n19cccn1.C[C@@H]5C6.C37=O.N45C.C48=O.N36
|
COC[C@@](C)(OC)C(=O)N1CCC[C@@](C)(NC(=O)c2cnn3ccc(O)nc23)C1
|
COC[C@@]C)OC))C=O)NCCC[C@@]C)NC=O)ccnncccO)nc96)))))))))))C6
|
[C][O][C][C@@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=N][N][C][=C][C][Branch1][C][O][=N][C][=Ring1][#Branch2][Ring1][#Branch1][C][Ring2][Ring1][Ring2]
|
c19cnn2ccc(O)nc12.N14CCC[C@]8(C)C1.C6[C@]7(C)C4=O.C59=O.CO6.O7C.N58
|
CN(C)c1ccc(CCC(=O)N2C[C@@H]3C(C(=O)Nc4nc(N)cs4)[C@H]3C2)cc1
|
CNC)ccccCCC=O)NC[C@@H]CC=O)NcncN)cs5)))))))[C@H]3C6)))))))))cc6
|
[C][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][Branch1][S][C][=Branch1][C][=O][N][C][=N][C][Branch1][C][N][=C][S][Ring1][=Branch1][C@H1][Ring1][N][C][Ring1][#C][C][=C][Ring2][Ring1][=Branch2]
|
c18ccc%10cc1.N15C[C@@H]2C9[C@H]2C1.c17nc(N)cs1.C%10CC5=O.CN8C.C69=O.N67
|
CNS(=O)(=O)CCC(=O)N[C@@]12C[C@@H]1CN(C(=O)[C@@H]([C@H](C)O)N(C)C)C2
|
CNS=O)=O)CCC=O)N[C@@]C[C@@H]3CNC=O)[C@@H][C@H]C)O))NC)C))))C6
|
[C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@@][C][C@@H1][Ring1][Ring1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][=Branch1][C@H1][Branch1][C][C][O][N][Branch1][C][C][C][C][Ring1][#C]
|
S6(=O)(=O)CCC3=O.[C@@]127C[C@@H]1CN4C2.C4(=O)[C@H]5[C@H](C)O.N5(C)C.CN6.N37
|
CCSCC[C@H](C)NC(=O)c1c[nH]nc1CCNC(=O)c1[nH]ccc1COC
|
CCSCC[C@H]C)NC=O)cc[nH]nc5CCNC=O)c[nH]ccc5COC
|
[C][C][S][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][NH1][C][=C][C][=Ring1][Branch1][C][O][C]
|
c1%12c[nH]nc13.c1%11[nH]ccc14.C%10C[C@@H]7C.C2%12=O.C3C8.C5%11=O.CC9.S9%10.N27.N58.C64.O6C
|
COC[C@]1(C)CCCN(C(=O)[C@@H]2C[C@H](C)N2C(=O)[C@H](C(C)C)C2CCC2)C1
|
COC[C@]C)CCCNC=O)[C@@H]C[C@H]C)N4C=O)[C@H]CC)C))CCCC4)))))))))))C6
|
[C][O][C][C@][Branch1][C][C][C][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Branch2]
|
[C@@]17(C)CCCN3C1.C4(=O)[C@@H]8C(C)C.[C@@H]16C[C@H](C)N14.C18CCC1.C36=O.CO5.C57
|
CN(Cc1cccc(CNC(=O)c2cc(F)ccc2Cl)c1)C(=O)c1nscc1N
|
CNCcccccCNC=O)cccF)ccc6Cl))))))))))c6)))))))C=O)cnscc5N
|
[C][N][Branch2][Ring1][S][C][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Cl][=C][Ring2][Ring1][C][C][=Branch1][C][=O][C][=N][S][C][=C][Ring1][Branch1][N]
|
c18cc(F)ccc1Cl.c19cccc%10c1.c17nscc1N.CN45.C38=O.C47=O.C59.C6%10.N36
|
CC(C)CCOCC(=O)NC[C@H]1[C@@H](C)CCN1C(=O)c1cnc2[nH]c(=N)sc2c1
|
CCC)CCOCC=O)NC[C@H][C@@H]C)CCN5C=O)ccnc[nH]c=N)sc5c9
|
[C][C][Branch1][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][C@@H1][Branch1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][N][=C][NH1][C][=Branch1][C][=N][S][C][Ring1][=Branch1][=C][Ring1][#Branch2]
|
c18cnc2[nH]c(=N)sc2c1.[C@H]19[C@@H](C)CCN14.CC(C)CC5.C6C3=O.C48=O.O56.N37.C79
|
CC(C)c1nc(-c2cc(Cl)c[nH]2)n(-c2ccc(Br)c(F)c2)n1
|
CCC)cnc-cccCl)c[nH]5)))))n-ccccBr)cF)c6))))))n5
|
[C][C][Branch1][C][C][C][N][=C][Branch1][O][C][=C][C][Branch1][C][Cl][=C][NH1][Ring1][=Branch1][N][Branch1][#C][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][F][=C][Ring1][Branch2][N][=Ring2][Ring1][Ring1]
|
c14ccc(Br)c(F)c1.c13nc5n4n1.c15cc(Cl)c[nH]1.CC3C
|
CCC=C(F)C(=O)N(CCNC(=O)Cc1ccc(OC)c(OC(F)F)c1)C(C)C
|
CCC=CF)C=O)NCCNC=O)CccccOC))cOCF)F)))c6)))))))))))CC)C
|
[C][C][C][=C][Branch1][C][F][C][=Branch1][C][=O][N][Branch2][Ring1][=N][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring1][N][C][Branch1][C][C][C]
|
c1%10ccc4c5c1.C=9(F)C2=O.C3(=O)C%10.O5C(F)F.CCC=9.N268.C6C7.C8(C)C.N37.O4C
|
Cc1ncoc1C(=O)N1CC[C@@H](NC(=O)c2cnc(C(F)F)nc2)[C@H](F)C1
|
Ccncoc5C=O)NCC[C@@H]NC=O)ccncCF)F))nc6))))))))[C@H]F)C6
|
[C][C][N][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][F][F][N][=C][Ring1][=Branch2][C@H1][Branch1][C][F][C][Ring2][Ring1][Ring1]
|
N13CC[C@@H]5[C@H](F)C1.c17cnc8nc1.Cc1ncoc16.C36=O.C47=O.C8(F)F.N45
|
COC[C@H]1C=CCCN1C(=O)[C@H]1CC(=O)CN1C(=O)[C@H]1CCN(C)C(=O)C1
|
COC[C@H]C=CCCN6C=O)[C@H]CC=O)CN5C=O)[C@H]CCNC)C=O)C6
|
[C][O][C][C@H1][C][=C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C][=Branch1][C][=O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Ring1][Branch2]
|
[C@H]16CCN(C)C(=O)C1.[C@H]17C=CCCN12.[C@H]15CC(=O)CN13.C25=O.C36=O.CO4.C47
|
CC(=O)c1cc(C(=O)N2CCO[C@@](C)(CNC(=O)CC[C@@H]3CCC(=O)N3)C2)co1
|
CC=O)cccC=O)NCCO[C@@]C)CNC=O)CC[C@@H]CCC=O)N5))))))))))C6)))))))co5
|
[C][C][=Branch1][C][=O][C][=C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][O][C@@][Branch1][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][Ring2][Ring1][Ring1][=C][O][Ring2][Ring1][#Branch2]
|
N14CCO[C@]9(C)C1.c17cc8co1.[C@@H]1%10CCC(=O)N1.C5(=O)CC%10.CC7=O.C48=O.C69.N56
|
CCc1cc(C(=O)N2CCN(C(=O)[C@H](C)OCC(F)(F)F)[C@@H](CF)C2)cc(O)n1
|
CCcccC=O)NCCNC=O)[C@H]C)OCCF)F)F))))))[C@@H]CF))C6)))))))ccO)n6
|
[C][C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C@@H1][Branch1][Ring1][C][F][C][Ring2][Ring1][C][=C][C][Branch1][C][O][=N][Ring2][Ring1][O]
|
c19cc7cc(O)n1.N13CCN4[C@@H]8C1.C4(=O)[C@@H]5C.C6C(F)(F)F.C37=O.CC9.O56.C8F
|
CC(=CC(=O)N1CC[C@@H](C(C)(C)C)C[C@H]1CNC(=O)C#C[C@H]1CCOC1)C(C)C
|
CC=CC=O)NCC[C@@H]CC)C)C))C[C@H]6CNC=O)C#C[C@H]CCOC5))))))))))))))))))CC)C
|
[C][C][=Branch2][Ring2][#Branch1][=C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][C@H1][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][#C][C@H1][C][C][O][C][Ring1][Branch1][C][Branch1][C][C][C]
|
C3(=O)C#C[C@H]1CCOC1.N12CC[C@@H]7C[C@H]16.CC=5C(C)C.C=5C2=O.C7(C)(C)C.C46.N34
|
COCC#CCN1CC[C@H](CNC(=O)c2c(C)nn(C)c2Cl)C1
|
COCC#CCNCC[C@H]CNC=O)ccC)nnC)c5Cl)))))))))C5
|
[C][O][C][C][#C][C][N][C][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][#Branch1][Cl][C][Ring1][P]
|
c17c(C)nn(C)c1Cl.N15CC[C@H]8C1.C4C#CC5.C37=O.CO4.C68.N36
|
CC(C)[C@@H]1[C@@H](NC(=O)[C@@H]2CCS2(=O)=O)CCN1C(=O)CCc1cccs1
|
CCC)[C@@H][C@@H]NC=O)[C@@H]CCS4=O)=O)))))))CCN5C=O)CCccccs5
|
[C][C][Branch1][C][C][C@@H1][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][C][S][Ring1][Ring2][=Branch1][C][=O][=O][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][C][C][=C][C][=C][S][Ring1][Branch1]
|
[C@@H]17[C@@H]5CCN14.[C@@H]16CCS1(=O)=O.C4(=O)CC8.c18cccs1.CC7C.C36=O.N35
|
CCc1occc1C(=O)N1CCC[C@H]1[C@@H](C)NC(=O)C1(C)CC=CC1
|
CCcoccc5C=O)NCCC[C@H]5[C@@H]C)NC=O)CC)CC=CC5
|
[C][C][C][O][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=C][C][Ring1][=Branch1]
|
c18occc16.N12CCC[C@H]17.C15(C)CC=CC1.C26=O.[C@H]47C.C35=O.CC8.N34
|
CCCCCCCC(=O)N1CC[C@@]2(NC(=O)C#CC(C)C)CCCC[C@H]12
|
CCCCCCCC=O)NCC[C@@]NC=O)C#CCC)C))))))CCCC[C@H]96
|
[C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][=N][N][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][C][C][C][C][C][C@H1][Ring1][P][Ring1][=C]
|
N13CC[C@@]25CCCC[C@H]12.CCCCCCCC3=O.C4(=O)C#CC(C)C.N45
|
CC(C)[C@@H](CNC(=O)CC1=CCCCC1)C(=O)N(CCO)C[C@H](O)CO
|
CCC)[C@@H]CNC=O)CC=CCCCC6))))))))))C=O)NCCO)))C[C@H]O)CO
|
[C][C][Branch1][C][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][=C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C][C@H1][Branch1][C][O][C][O]
|
C2(=O)CC1=CCCCC1.CC(C)[C@@H](C4)C3=O.C6[C@H](O)CO.N356.C5CO.N24
|
CC[C@H](C)C[C@@H](C)C(=O)N1CCCC[C@@H](CNC(=O)c2cc3c(s2)CCCC3)C1
|
CC[C@H]C)C[C@@H]C)C=O)NCCCC[C@@H]CNC=O)ccccs5)CCCC6)))))))))))C7
|
[C][C][C@H1][Branch1][C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][Ring2]
|
CC[C@H](C)C[C@@H](C)C4=O.c17cc2c(s1)CCCC2.N14CCCC[C@@H]8C1.C57=O.C68.N56
|
N#Cc1ccc(C(=O)N2CC[C@](O)(C(=O)Nc3c(Cl)cc(Cl)cc3Br)C2)c(F)c1
|
N#CccccC=O)NCC[C@]O)C=O)NccCl)ccCl)cc6Br)))))))))C5))))))cF)c6
|
[N][#C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][O][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][Branch1][C][Cl][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Br][C][Ring2][Ring1][C][C][Branch1][C][F][=C][Ring2][Ring1][O]
|
N#Cc1ccc8c(F)c1.c16c(Cl)cc(Cl)cc1Br.N14CC[C@@]7(O)C1.C48=O.C57=O.N56
|
Cn1ncc(C(=O)N2CCN([C@H]3CCCN(C(=O)c4cscc4Cl)C3)CC2)n1
|
CnnccC=O)NCCN[C@H]CCCNC=O)ccscc5Cl)))))))C6))))))CC6)))))))n5
|
[C][N][N][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][#Branch1][C@H1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][Cl][C][Ring1][=C][C][C][Ring2][Ring1][Ring2][=N][Ring2][Ring1][O]
|
N15CCN7CC1.[C@H]17CCCN6C1.Cn1ncc8n1.c19cscc1Cl.C58=O.C69=O
|
C[C@H]1CC[C@H](NC(=O)Cc2csnn2)CN1C(=O)C1C(C)(C)CCCC1(C)C
|
C[C@H]CC[C@H]NC=O)Cccsnn5))))))))CN6C=O)CCC)C)CCCC6C)C
|
[C][C@H1][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][=C][S][N][=N][Ring1][Branch1][C][N][Ring1][#C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Ring1][Branch2][Branch1][C][C][C]
|
C16C(C)(C)CCCC1(C)C.C[C@H]1CC[C@H]5CN14.c17csnn1.C3(=O)C7.C46=O.N35
|
O=C(CNc1nccs1)NC[C@@H]1C[C@H]1CNC(=O)[C@H]1CCc2ccccc2C1
|
O=CCNcnccs5)))))))NC[C@@H]C[C@H]3CNC=O)[C@H]CCcccccc6C%10
|
[O][=C][Branch1][#Branch2][C][N][C][=N][C][=C][S][Ring1][Branch1][N][C][C@@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2]
|
[C@H]19CCc2ccccc2C1.c18nccs1.O=C3C5.[C@@H]1%10C[C@H]1%11.C49=O.N58.N36.C6%10.C7%11.N47
|
C[C@@H]1CN(C(=O)c2n[nH]c3c2CCC3)CC[C@@H]1NC(=O)c1cncc2c[nH]nc12
|
C[C@@H]CNC=O)cn[nH]cc5CCC5)))))))))CC[C@@H]6NC=O)ccnccc[nH]nc95
|
[C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][C][C][Ring1][Branch1][C][C][C@@H1][Ring1][S][N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][NH1][N][=C][Ring1][=Branch2][Ring1][Branch1]
|
c18cncc2c[nH]nc12.C[C@@H]1CN4CC[C@@H]16.c17n[nH]c2c1CCC2.C47=O.C58=O.N56
|
CC1(C)CN(CC(=O)NC(C)(C)[C@H]2CCN(C(=O)c3ccccc3[N+](=O)[O-])C2)C1
|
CCC)CNCC=O)NCC)C)[C@H]CCNC=O)cccccc6[N+]=O)[O-])))))))))C5)))))))))C4
|
[C][C][Branch1][C][C][C][N][Branch2][Ring2][=Branch2][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Ring1][S][C][Ring2][Ring1][N]
|
c18ccccc1[N+](=O)[O-].CC1(C)CN6C1.[C@H]19CCN5C1.C6C4=O.C79(C)C.C58=O.N47
|
C[C@@]12CN(C(=O)C(=O)NCC3(F)CC(N)C3)C[C@]1(CO)C2
|
C[C@@]CNC=O)C=O)NCCF)CCN)C4))))))))C[C@]5CO))C6
|
[C][C@@][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][C][Branch1][C][N][C][Ring1][=Branch1][C][C@][Ring1][P][Branch1][Ring1][C][O][C][Ring2][Ring1][Ring2]
|
C[C@@]12CN4C[C@]18C2.C17(F)CC(N)C1.C4(=O)C5=O.N56.C67.C8O
|
Cc1ccccc1C1(C(=O)NC[C@H](CC(C)C)NC(=O)c2ccc[nH]2)CCCC1
|
Ccccccc6CC=O)NC[C@H]CCC)C)))NC=O)cccc[nH]5)))))))))))CCCC5
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][Ring1][Branch1][C][C][C][C][Ring2][Ring1][=Branch1]
|
Cc1ccccc19.C5[C@@H]6CC(C)C.C189CCCC1.c17ccc[nH]1.C38=O.C47=O.N35.N46
|
COC1(CNC(=O)[C@@H](O)C(F)(F)F)CN(C(=O)CCCc2nc(C3CC3)no2)C1
|
COCCNC=O)[C@@H]O)CF)F)F))))))CNC=O)CCCcncCCC3)))no5)))))))))C4
|
[C][O][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][C][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2][C][Ring2][Ring1][O]
|
C4(=O)[C@@H](O)C(F)(F)F.C169CN5C1.C5(=O)CCC8.c18nc%10no1.C1%10CC1.CO6.C79.N47
|
O=C(NC[C@@H]1[C@H]2CN(C(=O)c3cc4c(F)c(F)c(F)cc4[nH]3)C[C@@H]12)[C@H]1CC12CC2
|
O=CNC[C@@H][C@H]CNC=O)ccccF)cF)cF)cc6[nH]9))))))))))C[C@@H]65))))))))[C@H]CC3CC3
|
[O][=C][Branch2][Ring2][N][N][C][C@@H1][C@H1][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][=Branch2][NH1][Ring1][N][C][C@@H1][Ring2][Ring1][Ring2][Ring2][Ring1][Ring1][C@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1]
|
c18cc2c(F)c(F)c(F)cc2[nH]1.[C@@H]1%10[C@H]2CN6C[C@@H]12.[C@H]19CC12CC2.O=C59.C68=O.N57.C7%10
|
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