SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
C[C@H]1CC[C@H](C)N(C(=O)C2(C)CN(C(=O)c3cc4n(n3)CCC4)C2)C1
|
C[C@H]CC[C@H]C)NC=O)CC)CNC=O)cccnn5)CCC5))))))))C4)))))C6
|
[C][C@H1][C][C][C@H1][Branch1][C][C][N][Branch2][Ring2][Ring1][C][=Branch1][C][=O][C][Branch1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][C][Ring1][=Branch1][C][Ring1][#C][C][Ring2][Ring1][Branch2]
|
C[C@H]1CC[C@H](C)N5C1.c17cc2n(n1)CCC2.C18(C)CN6C1.C58=O.C67=O
|
CCc1noc(C(=O)N[C@@H]2CCCC[C@H]2CNC(=O)c2[nH]c(C)nc2C)c1C
|
CCcnocC=O)N[C@@H]CCCC[C@H]6CNC=O)c[nH]cC)nc5C)))))))))))))))))c5C
|
[C][C][C][=N][O][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][NH1][C][Branch1][C][C][=N][C][=Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][C]
|
c19noc7c1C.[C@@H]16CCCC[C@H]1%10.c18[nH]c(C)nc1C.C37=O.C48=O.CC9.N36.C5%10.N45
|
CO[C@@H](CSC)C(=O)N[C@H](Cn1ccnn1)C(=O)N[C@@H](C)c1cnn(C)c1C
|
CO[C@@H]CSC)))C=O)N[C@H]Cnccnn5))))))C=O)N[C@@H]C)ccnnC)c5C
|
[C][O][C@@H1][Branch1][Ring2][C][S][C][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch2][C][N][C][=C][N][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C]
|
c19cnn(C)c1C.[C@H]4(C7)C2=O.[C@@H]5(C8)C3=O.n18ccnn1.[C@@H]69C.CO4.S7C.N25.N36
|
COc1ccnc(CC(=O)N2C[C@H](C)[C@H](NC(=O)c3ccn4ccnc4c3)C2)n1
|
COcccncCC=O)NC[C@H]C)[C@H]NC=O)cccnccnc5c9)))))))))))C5)))))))n6
|
[C][O][C][=C][C][=N][C][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][N][C][=C][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C][Ring2][Ring1][C][=N][Ring2][Ring1][O]
|
c19ccn2ccnc2c1.c17ccnc%10n1.N15C[C@@H]8[C@@H](C)C1.C%10C5=O.C69=O.CO7.N68
|
CC(C)c1ocnc1C(=O)NCC1(NC(=O)CCC2CC2)CC1
|
CCC)cocnc5C=O)NCCNC=O)CCCCC3)))))))CC3
|
[C][C][Branch1][C][C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][=N][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring1][C][C][Ring1][O]
|
c18ocnc17.C4(=O)CC%10.C169CC1.CC8C.C37=O.C1%10CC1.N35.C59.N46
|
Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccn(C(F)F)n3)[C@H](C#N)C2)c(C)c1
|
CccccS=O)=O)NCCNC=O)cccnCF)F))n5))))))[C@H]C#N))C6)))))))cC)c6
|
[C][C][=C][C][=C][Branch2][Ring2][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][N][Branch1][=Branch1][C][Branch1][C][F][F][N][=Ring1][Branch2][C@H1][Branch1][Ring1][C][#N][C][Ring2][Ring1][C][C][Branch1][C][C][=C][Ring2][Ring1][N]
|
Cc1ccc(S5(=O)=O)c(C)c1.N15CCN4[C@H](C#N)C1.c16ccn7n1.C46=O.C7(F)F
|
Cc1cc(C(=O)N[C@H]2CC[C@@H]2NC(=O)c2ccc(C)c(F)c2)n[nH]1
|
CcccC=O)N[C@H]CC[C@@H]4NC=O)ccccC)cF)c6))))))))))))))n[nH]5
|
[C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch1][C][F][=C][Ring1][Branch2][=N][NH1][Ring2][Ring1][#Branch1]
|
c18ccc(C)c(F)c1.Cc1cc7n[nH]1.[C@H]15CC[C@@H]16.C37=O.C48=O.N35.N46
|
CO[C@H](CNC(=O)c1cn(C)nc1-c1nccs1)CNC(=O)[C@H]1CCCN1C
|
CO[C@H]CNC=O)ccnC)nc5-cnccs5)))))))))))))CNC=O)[C@H]CCCN5C
|
[C][O][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][C][=N][C][=C][S][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Ring1][Branch1][C]
|
c18cn(C)nc19.[C@H]17CCCN1C.[C@@H]4(C5)C6.c19nccs1.C28=O.C37=O.CO4.N25.N36
|
O=C(CNC(=O)CC1CCCCC1)NCCCN(C(=O)[C@H](F)C(F)(F)F)C1CC1
|
O=CCNC=O)CCCCCCC6))))))))))NCCCNC=O)[C@H]F)CF)F)F))))CCC3
|
[O][=C][Branch1][S][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][=Branch1][N][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][C][C][Ring1][Ring1]
|
C4(=O)[C@H](F)C(F)(F)F.C19CCCCC1.O=C2C5.C3(=O)C9.C6CC7.N478.C18CC1.N35.N26
|
COC(=O)[C@H]1C[C@@H]1[C@H](C)NC(=O)[C@H]1CCN(C(=O)[C@H](O)CSC)CC1(C)C
|
COC=O)[C@H]C[C@@H]3[C@H]C)NC=O)[C@H]CCNC=O)[C@H]O)CSC)))))CC6C)C
|
[C][O][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][S][C][C][C][Ring1][=N][Branch1][C][C][C]
|
[C@H]18CCN4CC1(C)C.C4(=O)[C@H](O)C6.[C@H]17C[C@@H]19.C27=O.[C@@H]59C.C38=O.CO2.N35.S6C
|
C=C(C)C[C@@H](NC(=O)[C@H](CCOC)OC)C(=O)NCCCNC(=O)OC
|
C=CC)C[C@@H]NC=O)[C@H]CCOC))))OC)))))C=O)NCCCNC=O)OC
|
[C][=C][Branch1][C][C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][O][C][O][C][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][O][C]
|
C=C(C)C[C@@H]7C3=O.C2(=O)[C@@H]6CC5.C8CC9.C14=O.N27.O5C.O6C.N38.N49.O1C
|
CC(=O)Nc1ccc(C)c(C(=O)N[C@H](CNC(=O)C(N)=O)c2ccc(C)cc2)c1
|
CC=O)NccccC)cC=O)N[C@H]CNC=O)CN)=O)))))ccccC)cc6)))))))))c6
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][Branch1][N][C][N][C][=Branch1][C][=O][C][Branch1][C][N][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][=Branch2]
|
c18ccc(C)c9c1.c1%10ccc(C)cc1.C5(=O)C(N)=O.[C@H]6%10C7.CC3=O.C49=O.N38.N46.N57
|
CC(C)[C@@H](C(=O)N1C[C@@]2(CNC(=O)[C@@H](O)CCN(C)C)C[C@H]1CO2)n1cccc1
|
CCC)[C@@H]C=O)NC[C@@]CNC=O)[C@@H]O)CCNC)C))))))))C[C@H]5CO5))))))))ncccc5
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][N][Branch1][C][C][C][C][C@H1][Ring1][S][C][O][Ring1][S][N][C][=C][C][=C][Ring1][Branch1]
|
N13C[C@@]28C[C@H]1CO2.CC(C)[C@H]7C3=O.C4(=O)[C@@H](O)CC6.n17cccc1.N6(C)C.C58.N45
|
C[C@H]1C[C@@H]1CC(=O)NCC1CC(NC(=O)Cn2c(=O)oc3ccccc32)C1
|
C[C@H]C[C@@H]3CC=O)NCCCCNC=O)Cnc=O)occcccc69))))))))))))C4
|
[C][C@H1][C][C@@H1][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][Ring2][Ring1][C]
|
n18c(=O)oc2ccccc21.C1%10CC7C1.C[C@H]1C[C@@H]19.C9C4=O.C5(=O)C8.N46.C6%10.N57
|
CC(=O)c1cc(C(=O)NC23CC(CNC(=O)CC4(O)CCOCC4)(C2)C3)n(C)c1
|
CC=O)cccC=O)NCCCCNC=O)CCO)CCOCC6))))))))))C4)C4))))))nC)c5
|
[C][C][=Branch1][C][=O][C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][O][C][C][Ring1][#Branch1][Branch1][Ring2][C][Ring1][S][C][Ring1][P][N][Branch1][C][C][C][=Ring2][Ring1][#Branch2]
|
c1%10cc9n(C)c1.C1%12(O)CCOCC1.C128CC%11(C1)C2.C6(=O)C%12.CC%10=O.C59=O.N58.C7%11.N67
|
C=C[C@@H](CC)CC(=O)N1CCC([C@H](NC(=O)c2cncnc2C)C(C)C)CC1
|
C=C[C@@H]CC))CC=O)NCCC[C@H]NC=O)ccncnc6C)))))))))CC)C)))CC6
|
[C][=C][C@@H1][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][N][=C][N][=C][Ring1][=Branch1][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][Ring2]
|
C=C[C@@H](CC)CC3=O.N13CCC7CC1.c16cncnc1C.[C@H]57C(C)C.C46=O.N45
|
COc1nn(C)cc1C(=O)N1CCOC[C@H]1CNC(=O)[C@H](NC(N)=O)C(C)C
|
COcnnC)cc5C=O)NCCOC[C@H]6CNC=O)[C@H]NCN)=O)))CC)C
|
[C][O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][O][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][Branch1][C][C][C]
|
c15nn(C)cc18.N12CCOC[C@H]19.C3(=O)[C@H]7C(C)C.C28=O.C4(N)=O.CO5.C69.N36.N47
|
CCCC(=O)NCC(=O)NC1CC(N(C)C(=O)CN2CCN(C3CC3)C2=O)C1
|
CCCC=O)NCC=O)NCCCNC)C=O)CNCCNCCC3)))C5=O)))))))))C4
|
[C][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][Branch2][=O][C][Ring2][Ring1][C]
|
N1%10CCN%11C1=O.CCCC4=O.C18CC9C1.C7C5=O.C6(=O)C%10.N69C.C1%11CC1.N47.N58
|
CN1C[C@@H](NC(=O)[C@@H]2CSCN2C)C2(CC2)C1=O
|
CNC[C@@H]NC=O)[C@@H]CSCN5C))))))))CCC3))C5=O
|
[C][N][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C@@H1][C][S][C][N][Ring1][Branch1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][S][=O]
|
CN1C[C@@H]4C2(CC2)C1=O.[C@@H]15CSCN1C.C35=O.N34
|
CS[C@H](C)CC(=O)NCc1nocc1C(=O)Nc1ccsc1C(C)C
|
CS[C@H]C)CC=O)NCcnocc5C=O)Ncccsc5CC)C
|
[C][S][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=N][O][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][S][C][=Ring1][Branch1][C][Branch1][C][C][C]
|
[C@@H]5(C)CC2=O.c18nocc17.c16ccsc19.C37=O.C9(C)C.CS5.N24.C48.N36
|
CN(C)CCOCC(=O)N1C[C@H](CNC(=O)C[C@H]2CCc3ccccc32)[C@H](O)C1
|
CNC)CCOCC=O)NC[C@H]CNC=O)C[C@H]CCcccccc69)))))))))))))[C@H]O)C5
|
[C][N][Branch1][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C@H1][Branch1][C][O][C][Ring2][Ring1][Ring2]
|
C5(=O)C[C@H]1CCc2ccccc21.N14C[C@@H](O)[C@@H]%10C1.C7C4=O.CN8C.C8C6.O67.C9%10.N59
|
Cc1ccc(C(=O)NCC(F)(F)Cl)cc1NC(=O)c1ccco1
|
CccccC=O)NCCF)F)Cl)))))cc6NC=O)cccco5
|
[C][C][=C][C][=C][Branch1][#C][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][Cl][C][=C][Ring1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1]
|
Cc1ccc7cc15.C4C(F)(F)Cl.c16ccco1.C27=O.C36=O.N24.N35
|
COCC[C@H](CNC(=O)c1cc(=O)n(C)o1)NC(=O)c1ccn2ncnc2c1
|
COCC[C@H]CNC=O)ccc=O)nC)o5))))))))NC=O)cccnncnc5c9
|
[C][O][C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][N][Branch1][C][C][O][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=C][N][N][=C][N][=C][Ring1][Branch1][C][=Ring1][=Branch2]
|
c19ccn2ncnc2c1.c18cc(=O)n(C)o1.C5C[C@@H]6C7.C38=O.C49=O.CO5.N37.N46
|
C[C@@H]1CCn2cc(C(=O)N3CCN(C(=O)c4c[nH]ccc4=O)CC3)nc2C1
|
C[C@@H]CCnccC=O)NCCNC=O)cc[nH]ccc6=O))))))))CC6)))))))nc5C9
|
[C][C@@H1][C][C][N][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][Ring1][=Branch1][=O][C][C][Ring1][#C][N][=C][Ring2][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
C[C@@H]1CCn2cc7nc2C1.N15CCN6CC1.c18c[nH]ccc1=O.C57=O.C68=O
|
C[C@@H](CN(C)C(=O)c1cnc2c(c1)OCCN2)NC(=O)CCCc1cnn[nH]1
|
C[C@@H]CNC)C=O)ccnccc6)OCCN6))))))))))))NC=O)CCCccnn[nH]5
|
[C][C@@H1][Branch2][Ring1][#Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][N][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][C][C][=C][N][=N][NH1][Ring1][Branch1]
|
c17cnc2c(c1)OCCN2.C4(=O)CCC8.c18cnn[nH]1.C[C@H]5C6.N36C.C37=O.N45
|
CC(C)(F)C(=O)N1C[C@@H](CO)C2(CCN(C(=O)C=Cc3cn[nH]c3)CC2)C1
|
CCC)F)C=O)NC[C@@H]CO))CCCNC=O)C=Cccn[nH]c5))))))))CC6)))))C5
|
[C][C][Branch1][C][C][Branch1][C][F][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][Branch2][Ring1][#Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][=N][NH1][C][=Ring1][Branch1][C][C][Ring1][#C][C][Ring2][Ring1][Branch1]
|
N14C[C@@H]7C2(CCN5CC2)C1.CC(C)(F)C4=O.C=6c1cn[nH]c1.C5(=O)C=6.C7O
|
CC1(C)CN(C(=O)C=CBr)C[C@@H]1NC(=O)[C@H]1CCC[C@H]1F
|
CCC)CNC=O)C=CBr))))C[C@@H]5NC=O)[C@H]CCC[C@H]5F
|
[C][C][Branch1][C][C][C][N][Branch1][Branch2][C][=Branch1][C][=O][C][=C][Br][C][C@@H1][Ring1][O][N][C][=Branch1][C][=O][C@H1][C][C][C][C@H1][Ring1][Branch1][F]
|
CC1(C)CN2C[C@@H]14.[C@H]15CCC[C@H]1F.C2(=O)C=CBr.C35=O.N34
|
Cc1cc(C(=O)NC2(CN(C)C(=O)[C@@H](C)[C@@H](C)S(C)(=O)=O)CC2)cnc1C
|
CcccC=O)NCCNC)C=O)[C@@H]C)[C@@H]C)SC)=O)=O)))))))CC3)))))cnc6C
|
[C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][#Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C@@H1][Branch1][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][S][=C][N][=C][Ring2][Ring1][=Branch2][C]
|
C4(=O)[C@@H](C)[C@@H](C)S(C)(=O)=O.Cc1cc7cnc1C.C158CC1.C37=O.N46C.N35.C68
|
CC(C)N(C(=O)c1c[nH]nc1CCNC(=O)[C@@H]1CCC2(CCC2)C1)C1CC1
|
CCC)NC=O)cc[nH]nc5CCNC=O)[C@@H]CCCCCC4)))C5)))))))))))))))CCC3
|
[C][C][Branch1][C][C][N][Branch2][Ring1][P][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][Branch2][C][C][C][Ring1][Ring1]
|
[C@@H]18CCC2(CCC2)C1.c19c[nH]nc1%10.CC5C.N357.C39=O.C%10C6.C48=O.C17CC1.N46
|
CC(C)(C)OC(=O)NC[C@H](CO)N[C@H]1CCCCC[C@@H]1NC(=O)OC(C)(C)C
|
CCC)C)OC=O)NC[C@H]CO))N[C@H]CCCCC[C@@H]7NC=O)OCC)C)C
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][C][O][N][C@H1][C][C][C][C][C][C@@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]
|
[C@H]1%11CCCCC[C@@H]13.C9[C@@H]%10CO.CC7(C)C.C8(C)(C)C.C25=O.C46=O.O27.N59.N%10%11.N63.O48
|
C#Cc1ccc(C(=O)N2C[C@H]3C[C@H]2CN(C(=O)CCc2cc(C)[nH]n2)C3)cc1
|
C#CccccC=O)NC[C@H]C[C@H]5CNC=O)CCcccC)[nH]n5))))))))C6)))))))))cc6
|
[C][#C][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][C][=C][Branch1][C][C][NH1][N][=Ring1][=Branch1][C][Ring1][S][C][=C][Ring2][Ring1][#Branch2]
|
N14C[C@H]2C[C@H]1CN5C2.C#Cc1ccc6cc1.c17cc(C)[nH]n1.C5(=O)CC7.C46=O
|
CC(C)C1=NO[C@@](C)(C(=O)N[C@@H](CNC(=O)C2(C#N)CC2)C(C)(C)C)C1
|
CCC)C=NO[C@@]C)C=O)N[C@@H]CNC=O)CC#N))CC3))))))CC)C)C)))))C5
|
[C][C][Branch1][C][C][C][=N][O][C@@][Branch1][C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch1]
|
CC(C)C1=NO[C@]7(C)C1.[C@H]5(C6)C(C)(C)C.C18(C#N)CC1.C37=O.C48=O.N35.N46
|
N#Cc1ccsc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1
|
N#Ccccsc5C=O)NCCO[C@@]CCNC=O)ccccCl)cF)c6)))))))C5))))C6
|
[N][#C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][O][C@@][Branch2][Ring1][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][F][=C][Ring1][Branch2][C][Ring1][#C][C][Ring2][Ring1][Ring2]
|
N14CCO[C@@]2(CCN5C2)C1.c17ccc(Cl)c(F)c1.N#Cc1ccsc16.C46=O.C57=O
|
CCOc1cc(NC[C@H]2C[C@H](CNC(=O)Cn3ccnc3C)CO2)ncn1
|
CCOcccNC[C@H]C[C@H]CNC=O)Cnccnc5C))))))))))CO5)))))))ncn6
|
[C][C][O][C][=C][C][Branch2][Ring1][O][N][C][C@H1][C][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][N][C][=C][N][=C][Ring1][Branch1][C][C][O][Ring1][S][=N][C][=N][Ring2][Ring1][Branch2]
|
c16cc9ncn1.[C@H]1%11C[C@H]%12CO1.n1%10ccnc1C.C4(=O)C%10.CC5.O56.N79.C7%11.C8%12.N48
|
Cc1cc(C(=O)NC2C[C@@H]3CN(C(=O)c4cnncc4O)C[C@H]3C2)[nH]c1C
|
CcccC=O)NCC[C@@H]CNC=O)ccnncc6O))))))))C[C@H]5C8))))))))))[nH]c5C
|
[C][C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][N][=N][C][=C][Ring1][=Branch1][O][C][C@H1][Ring1][=C][C][Ring1][P][NH1][C][=Ring2][Ring1][=Branch2][C]
|
C17C[C@@H]2CN6C[C@H]2C1.Cc1cc8[nH]c1C.c19cnncc1O.C58=O.C69=O.N57
|
CC[C@@H](C(=O)N1CCC(CC)(NC(=O)CCc2ccccc2C)CC1)[C@@H](C)O
|
CC[C@@H]C=O)NCCCCC))NC=O)CCcccccc6C)))))))))))CC6)))))))[C@@H]C)O
|
[C][C][C@@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][C][Branch1][P][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring2][Ring1][Ring2][C@@H1][Branch1][C][C][O]
|
CC[C@@H](C3=O)[C@@H](C)O.N13CCC56CC1.c17ccccc1C.C4(=O)CC7.C6C.N45
|
CCCCSCC(=O)N[C@H]1CC=C(C(=O)N2CCC[C@@H](C3CCC3)C2)C1
|
CCCCSCC=O)N[C@H]CC=CC=O)NCCC[C@@H]CCCC4))))C6)))))))C5
|
[C][C][C][C][S][C][C][=Branch1][C][=O][N][C@H1][C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][#Branch2][C][Ring1][P]
|
N15CCC[C@@H](C2CCC2)C1.[C@H]18CC=C(C5=O)C1.CCCC6.C7C4=O.S67.N48
|
C=CCC1(NC(=O)CC2CCN(C(C)=O)CC2)CN(C(=O)CSC(F)(F)F)C1
|
C=CCCNC=O)CCCCNCC)=O))CC6)))))))))CNC=O)CSCF)F)F)))))C4
|
[C][=C][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][=Branch2][C][N][Branch1][#C][C][=Branch1][C][=O][C][S][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][=Branch2]
|
C19CCN4CC1.C168CN5C1.S7C(F)(F)F.C3(=O)C9.C5(=O)C7.C=CC8.C4(C)=O.N36
|
Cc1c(O)ccc(C(=O)N2C[C@@H](NC(=O)[C@]3(C)CCCO3)CC3(CC3)C2)c1C
|
CccO)cccC=O)NC[C@@H]NC=O)[C@]C)CCCO5)))))))CCCC3))C6)))))))c6C
|
[C][C][=C][Branch1][C][O][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][O][Ring1][=Branch1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][P][=C][Ring2][Ring1][#Branch2][C]
|
Cc1c(O)ccc8c1C.N14C[C@@H]6CC2(CC2)C1.[C@@]17(C)CCCO1.C48=O.C57=O.N56
|
O=C(OCc1ccn(CC(F)(F)F)n1)c1cccnc1SC1CCCC1
|
O=COCcccnCCF)F)F)))n5)))))))ccccnc6SCCCCC5
|
[O][=C][Branch2][Ring1][Branch1][O][C][C][C][=C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][=Ring1][#Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][S][C][C][C][C][C][Ring1][Branch1]
|
c14cccnc17.c16ccn5n1.C5C(F)(F)F.C18CCCC1.O=C24.O23.C36.S78
|
CC(C)N(CCCNC(=O)CCSCC(N)=O)C(=O)[C@@H]1CCC[C@@H]1O
|
CCC)NCCCNC=O)CCSCCN)=O)))))))))))C=O)[C@@H]CCC[C@@H]5O
|
[C][C][Branch1][C][C][N][Branch2][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][C][S][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][C@@H1][C][C][C][C@@H1][Ring1][Branch1][O]
|
[C@@H]19CCC[C@@H]1O.C2(=O)CC7.C5CC6.C8C(N)=O.CC4C.N345.C39=O.N26.S78
|
O=C(NC[C@]1(O)CCSC1)[C@@H]1CCCN(C(=O)CN2CCSCC2)CC1
|
O=CNC[C@]O)CCSC5)))))))[C@@H]CCCNC=O)CNCCSCC6))))))))CC7
|
[O][=C][Branch1][=N][N][C][C@][Branch1][C][O][C][C][S][C][Ring1][=Branch1][C@@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][N][C][C][S][C][C][Ring1][=Branch1][C][C][Ring1][S]
|
[C@@H]17CCCN4CC1.[C@@]18(O)CCSC1.N16CCSCC1.C4(=O)C6.O=C37.N35.C58
|
N=c1nc(C2CCCC2)[nH]c(=NC[C@@H](O)CNC(=O)CCc2ccsc2)[nH]1
|
N=cncCCCCC5)))))[nH]c=NC[C@@H]O)CNC=O)CCcccsc5)))))))))))))[nH]6
|
[N][=C][N][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][NH1][C][=Branch2][Ring1][=Branch1][=N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][C][C][C][=C][S][C][=Ring1][Branch1][NH1][Ring2][Ring1][#Branch2]
|
N=c1nc6[nH]c(=NC[C@@H](O)C4)[nH]1.C16CCCC1.C3(=O)CC5.c15ccsc1.N34
|
C#CCC(C)(C)C(=O)NC[C@@H]1CC[C@H](NC(=O)C2C[C@H](C)C[C@@H](C)C2)C1
|
C#CCCC)C)C=O)NC[C@@H]CC[C@H]NC=O)CC[C@H]C)C[C@@H]C)C6))))))))C5
|
[C][#C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C@H1][Branch1][C][C][C][C@@H1][Branch1][C][C][C][Ring1][Branch2][C][Ring1][S]
|
C#CCC(C)(C)C3=O.C17C[C@H](C)C[C@@H](C)C1.[C@@H]18CC[C@H]6C1.C47=O.N35.C58.N46
|
CCc1ccc(OC)c(C(=O)N(C)CC(=O)Nc2ccccc2)c1
|
CCccccOC))cC=O)NC)CC=O)Ncccccc6)))))))))))c6
|
[C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1]
|
c19ccc5c8c1.c17ccccc1.C6C4=O.C38=O.N36C.CC9.O5C.N47
|
CC[C@@H](C(=O)N[C@@H]1CC12CC(NC(=O)c1nc3sccn3c1C)C2)N(CC)CC
|
CC[C@@H]C=O)N[C@@H]CC3CCNC=O)cncsccn5c8C)))))))))))C4))))))))NCC))CC
|
[C][C][C@@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][Ring1][Ring1][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][N][=C][S][C][=C][N][Ring1][Branch1][C][=Ring1][Branch2][C][C][Ring1][S][N][Branch1][Ring1][C][C][C][C]
|
c1%11nc2sccn2c1C.[C@@H]19CC12CC%10C2.CC[C@H]6C4=O.C5%11=O.N678.N49.N5%10.C7C.C8C
|
O=C(c1ccncc1)N1CCC[C@H]2[C@H]1CCCN2C(=O)c1cc(O)cc(F)c1F
|
O=Ccccncc6))))))NCCC[C@H][C@H]6CCCN6C=O)cccO)ccF)c6F
|
[O][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][C][C][C@H1][C@H1][Ring1][=Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][F][=C][Ring1][Branch2][F]
|
N13CCC[C@H]2[C@H]1CCCN24.c16cc(O)cc(F)c1F.c15ccncc1.O=C35.C46=O
|
COC(=O)c1cc(CN2CC[C@H](c3ccco3)C2)on1
|
COC=O)cccCNCC[C@H]cccco5)))))C5))))))on5
|
[C][O][C][=Branch1][C][=O][C][C][=C][Branch2][Ring1][C][C][N][C][C][C@H1][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][#Branch2][O][N][=Ring1][S]
|
c16cc7on1.N15CC[C@H]8C1.c18ccco1.C46=O.CO4.C57
|
Cc1nocc1CC(=O)N[C@@H]1CCC[C@@H]2CN(C(=O)c3cc(N)nc(Cl)c3)C[C@H]21
|
Ccnocc5CC=O)N[C@@H]CCC[C@@H]CNC=O)cccN)ncCl)c6)))))))C[C@H]59
|
[C][C][=N][O][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][N][=N][C][Branch1][C][Cl][=C][Ring1][Branch2][C][C@H1][Ring1][#C][Ring2][Ring1][Ring1]
|
[C@@H]16CCC[C@@H]2CN5C[C@H]21.c17cc(N)nc(Cl)c1.Cc1nocc18.C8C4=O.C57=O.N46
|
O=C(CCc1cccnc1Cl)NC[C@@H](F)C1CCN(C(=O)c2ns[nH]c2=O)CC1
|
O=CCCccccnc6Cl)))))))))NC[C@@H]F)CCCNC=O)cns[nH]c5=O)))))))CC6
|
[O][=C][Branch1][N][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Cl][N][C][C@@H1][Branch1][C][F][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=N][S][NH1][C][Ring1][Branch1][=O][C][C][Ring1][=C]
|
c18cccnc1Cl.C17CCN4CC1.c16ns[nH]c1=O.O=C3CC8.C5[C@H]7F.C46=O.N35
|
CN(C[C@H]1CCCN1C(=O)CCc1ccc[nH]1)C(=O)C=CCCc1ccccc1
|
CNC[C@H]CCCN5C=O)CCcccc[nH]5))))))))))))))C=O)C=CCCcccccc6
|
[C][N][Branch2][Ring1][=Branch1][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][=C][C][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
[C@H]16CCCN12.c18ccccc1.C2(=O)CC7.c17ccc[nH]1.C3(=O)C=5.C=5CC8.CN34.C46
|
CCN(C[C@@H](C)NC(=O)C(=C(C)C)c1ccccc1)C(=O)[C@H]1C[C@H](N(C)C)C1
|
CCNC[C@@H]C)NC=O)C=CC)C))cccccc6)))))))))))C=O)[C@H]C[C@H]NC)C))C4
|
[C][C][N][Branch2][Ring1][O][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][=Branch1][=C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][#Branch1]
|
C2(=O)C=9c1ccccc1.[C@H]18C[C@H]7C1.C5[C@H]6C.N345.C=9(C)C.C38=O.N7(C)C.CC4.N26
|
CC(C)CCCCC(=O)NC[C@@H]1CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1Cl
|
CCC)CCCCC=O)NC[C@@H]CC[C@@H]4NC=O)ccc[N+]=O)[O-]))ccc6Cl
|
[C][C][Branch1][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][Cl]
|
c16cc([N+](=O)[O-])ccc1Cl.CC(C)CCCCC2=O.[C@@H]17CC[C@@H]15.C36=O.N24.C47.N35
|
CC(C)Oc1ccc(C(=O)N(C)CCCNC(=O)[C@@H]2CC[C@H]3[C@@H]2C3(F)F)c(Cl)c1
|
CCC)OccccC=O)NC)CCCNC=O)[C@@H]CC[C@H][C@@H]5C3F)F))))))))))))))cCl)c6
|
[C][C][Branch1][C][C][O][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C@H1][C@@H1][Ring1][Branch1][C][Ring1][Ring1][Branch1][C][F][F][C][Branch1][C][Cl][=C][Ring2][Ring1][=Branch2]
|
c17ccc%11c(Cl)c1.[C@@H]1%10CC[C@H]2[C@@H]1C2(F)F.C8CC9.CC6C.C4%11=O.N48C.C5%10=O.O67.N59
|
CO[C@H](C(=O)N[C@@]1(C(=O)N[C@@H](C)Cc2cnn(C)c2)CCN(C)C1)C1CCC1
|
CO[C@H]C=O)N[C@@]C=O)N[C@@H]C)CccnnC)c5)))))))))CCNC)C5)))))))CCCC4
|
[C][O][C@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C@@][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][N][Branch1][C][C][C][Ring2][Ring1][C][C][C][C][C][Ring1][Ring2]
|
[C@]168CCN(C)C1.c1%10cnn(C)c1.[C@H]59C3=O.[C@H]7(C)C%10.C19CCC1.C48=O.CO5.N36.N47
|
COC[C@@]1(CNC(=O)[C@@H](C2CC2)N(C)C)CCCN1C(=O)C1=CCSC1
|
COC[C@@]CNC=O)[C@@H]CCC3)))NC)C))))))CCCN5C=O)C=CCSC5
|
[C][O][C][C@@][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][C][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][C][S][C][Ring1][Branch1]
|
[C@]189CCCN14.C4(=O)C1=CCSC1.C3(=O)[C@H]7%10.C1%10CC1.N7(C)C.CO5.C58.C69.N36
|
COCOc1cc(F)cc(S(=O)(=O)Nc2ccc(C3(C#N)CCCC3)cc2)c1
|
COCOcccF)ccS=O)=O)NccccCC#N))CCCC5)))))cc6))))))))c6
|
[C][O][C][O][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring1][=C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][Branch1][N][C][Branch1][Ring1][C][#N][C][C][C][C][Ring1][#Branch1][C][=C][Ring1][=N][=C][Ring2][Ring1][Branch2]
|
c14cc(F)cc(S5(=O)=O)c1.c16ccc7cc1.C17(C#N)CCCC1.COCO4.N56
|
CC[C@H](CC(=O)N1CCN(C(=O)c2cnc3ccncc3c2)C[C@@H]1CF)SC
|
CC[C@H]CC=O)NCCNC=O)ccncccncc6c%10)))))))))))C[C@@H]6CF))))))))))SC
|
[C][C][C@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][C][=C][N][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C@@H1][Ring2][Ring1][C][C][F][S][C]
|
c17cnc2ccncc2c1.N14CCN5C[C@@H]18.CC[C@@H]6CC4=O.C57=O.C8F.S6C
|
N#Cc1cccc(C2(C(=O)N(O)Cc3cn(Cc4ccccn4)nn3)CC2)c1
|
N#CcccccCC=O)NO)CccnCcccccn6)))))))nn5))))))))CC3)))c6
|
[N][#C][C][=C][C][=C][C][Branch2][Ring2][Branch1][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][Branch1][C][O][C][C][=C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][N][=N][Ring1][N][C][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][#Branch2]
|
N#Cc1cccc9c1.C5(=O)N(O)C7.c17cn6nn1.c18ccccn1.C159CC1.C68
|
C#CCN(C(=O)Cc1ccsn1)C1CCN(C(=O)[C@@H](CO)C(C)(C)C)CC1
|
C#CCNC=O)Ccccsn5)))))))CCCNC=O)[C@@H]CO))CC)C)C))))CC6
|
[C][#C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][S][N][=Ring1][Branch1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][#C]
|
C3(=O)[C@@H](CO)C(C)(C)C.C15CCN3CC1.c16ccsn1.C2(=O)C6.C#CC4.N245
|
CC[C@H](C)CCCC(=O)N1CC[C@@H](CCC(=O)N2CC[C@@H]2C(=O)NC)C1
|
CC[C@H]C)CCCC=O)NCC[C@@H]CCC=O)NCC[C@@H]4C=O)NC))))))))))C5
|
[C][C][C@H1][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Ring1][P]
|
CC[C@H](C)CCCC3=O.N13CC[C@@H]7C1.C7CC4=O.N14CC[C@@H]16.C56=O.N5C
|
Cc1c(C=CC(=O)N2CCN(C(=O)CC3(C(F)F)CC3)[C@@H](C)C2)cnn1C
|
CccC=CC=O)NCCNC=O)CCCF)F))CC3)))))[C@@H]C)C6)))))))))cnn5C
|
[C][C][=C][Branch2][Ring2][=Branch1][C][=C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][Branch1][=Branch1][C][Branch1][C][F][F][C][C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][Ring1][S][C][=N][N][Ring2][Ring1][=Branch2][C]
|
Cc1c(C=6)cnn1C.N14CCN5[C@@H](C)C1.C=6C4=O.C5(=O)C7.C178CC1.C8(F)F
|
CN(C)CCCN(C)C(=O)CC1(NC(=O)[C@H]2CC(=O)N(C)C2)CC1
|
CNC)CCCNC)C=O)CCNC=O)[C@H]CC=O)NC)C5)))))))CC3
|
[C][N][Branch1][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][#Branch1][C][C][Ring1][=N]
|
[C@H]18CC(=O)N(C)C1.C5CC6.C3(=O)C9.C179CC1.CN5C.N36C.C48=O.N47
|
CCCCn1ccc(C(=O)N[C@@H]2C=CCN(C(=O)CCCc3ccsc3)C2)n1
|
CCCCncccC=O)N[C@@H]C=CCNC=O)CCCcccsc5)))))))))C6))))))))n5
|
[C][C][C][C][N][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][C][=C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][S][=N][Ring2][Ring1][Branch2]
|
[C@@H]16C=CCN5C1.n18ccc7n1.C5(=O)CCC9.c19ccsc1.CCCC8.C47=O.N46
|
C#CCOCCC(=O)N(C)Cc1ccc(CNC(=O)[C@H](O)CCCCC)cc1
|
C#CCOCCC=O)NC)CccccCNC=O)[C@H]O)CCCCC)))))))))cc6
|
[C][#C][C][O][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][C][=C][Branch1][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][C][C][C][=C][Ring1][P]
|
C3(=O)[C@H](O)CCCCC.c18ccc9cc1.C5CC2=O.C#CC4.N26C.O45.C68.C79.N37
|
CC[C@H](CC(=O)N[C@H](C(=O)NCC[C@](C)(O)C1CC1)C(C)C)C(C)C
|
CC[C@H]CC=O)N[C@H]C=O)NCC[C@]C)O)CCC3))))))))CC)C))))))CC)C
|
[C][C][C@H1][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][Branch1][C][O][C][C][C][Ring1][Ring1][C][Branch1][C][C][C][C][Branch1][C][C][C]
|
CC[C@H](CC2=O)C(C)C.[C@@H]4(C3=O)C(C)C.C5C[C@]6(C)O.C16CC1.N24.N35
|
Cc1cc(CC(=O)N2CC[C@@H]2C(=O)N2CCC[C@H](c3ccccc3)C2)no1
|
CcccCC=O)NCC[C@@H]4C=O)NCCC[C@H]cccccc6))))))C6)))))))))))))no5
|
[C][C][=C][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=N][O][Ring2][Ring1][#Branch2]
|
N15CCC[C@H]8C1.Cc1cc7no1.c18ccccc1.N14CC[C@@H]16.C7C4=O.C56=O
|
C=CCC1(NC(=O)[C@@H]2CCC(=O)NC2)CN(C(=O)[C@H](O)c2cccc(F)c2)C1
|
C=CCCNC=O)[C@@H]CCC=O)NC6))))))))CNC=O)[C@H]O)cccccF)c6))))))))C4
|
[C][=C][C][C][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring2][Ring1][=Branch2]
|
[C@@H]16CCC(=O)NC1.c18cccc(F)c1.C157CN4C1.C4(=O)[C@@H]8O.C=CC7.C36=O.N35
|
Cc1cc(C(=O)NCC[C@@H]2CCCN(C(=O)[C@@H](F)C(C)(C)O)CC2)sn1
|
CcccC=O)NCC[C@@H]CCCNC=O)[C@@H]F)CC)C)O))))CC7)))))))))))sn5
|
[C][C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][C][Branch1][C][C][O][C][C][Ring1][#C][S][N][=Ring2][Ring1][=Branch2]
|
[C@@H]17CCCN4CC1.C4(=O)[C@@H](F)C(C)(C)O.Cc1cc6sn1.C36=O.C5C7.N35
|
CO[C@H]1C[C@@H](C(=O)N2CCO[C@@H]([C@H](C)NC(=O)c3ccc(N(C)C)c(F)c3)C2)C1
|
CO[C@H]C[C@@H]C=O)NCCO[C@@H][C@H]C)NC=O)ccccNC)C))cF)c6)))))))))C6)))))))C4
|
[C][O][C@H1][C][C@@H1][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][N][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][Branch1][C][F][=C][Ring1][#Branch2][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][O]
|
c1%10ccc8c(F)c1.N14CCO[C@@H]%11C1.[C@H]16C[C@@H]9C1.C49=O.[C@@H]7%11C.C5%10=O.N8(C)C.CO6.N57
|
CON=CC(=O)N(C)CC1(CNC(=O)[C@@H]2CN3CCN2CC3)CC1
|
CON=CC=O)NC)CCCNC=O)[C@@H]CNCCN6CC6)))))))))))CC3
|
[C][O][N][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][C][N][C][C][N][Ring1][=Branch1][C][C][Ring1][=Branch1][C][C][Ring1][#C]
|
[C@@H]18CN2CCN1CC2.CON=CC4=O.C19%10CC1.N46C.C58=O.C69.C7%10.N57
|
O=C(Nc1ccc(N2CCCC2)cn1)N1CCc2c(Cl)ccc(Br)c2C1
|
O=CNccccNCCCC5)))))cn6)))))))NCCccCl)cccBr)c6C%10
|
[O][=C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][=N][Ring1][O][N][C][C][C][=C][Branch1][C][Cl][C][=C][C][Branch1][C][Br][=C][Ring1][Branch2][C][Ring1][N]
|
N14CCc2c(Cl)ccc(Br)c2C1.c15ccc6cn1.N16CCCC1.O=C34.N35
|
COCCCCCC(=O)N1CC(C)(NC(=O)[C@H](C)OCC(F)(F)F)C1
|
COCCCCCC=O)NCCC)NC=O)[C@H]C)OCCF)F)F)))))))C4
|
[C][O][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][S]
|
C4CCCCC2=O.N12CC7(C)C1.C3(=O)[C@@H]5C.C6C(F)(F)F.CO4.N37.O56
|
C[C@@H](CC(=O)N1CC[C@H](C2(NC(=O)COC3CCC3)CC2)C1)N(C)C
|
C[C@@H]CC=O)NCC[C@H]CNC=O)COCCCC4))))))))CC3)))C5)))))))NC)C
|
[C][C@@H1][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Branch1][C][Branch1][=C][N][C][=Branch1][C][=O][C][O][C][C][C][C][Ring1][Ring2][C][C][Ring1][N][C][Ring1][P][N][Branch1][C][C][C]
|
N14CC[C@H](C29CC2)C1.C[C@H]8CC4=O.C5(=O)C6.C17CCC1.N8(C)C.N59.O67
|
CCc1ncc(C(=O)NCCCN(C)C(=O)c2cc(C(C)(C)C)[nH]c2C)c(C)n1
|
CCcnccC=O)NCCCNC)C=O)cccCC)C)C))[nH]c5C)))))))))))))cC)n6
|
[C][C][C][=N][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][NH1][C][=Ring1][=Branch2][C][C][Branch1][C][C][=N][Ring2][Ring1][O]
|
c19ncc7c(C)n1.c18cc%10[nH]c1C.C5CC6.C%10(C)(C)C.C37=O.N46C.C48=O.CC9.N35
|
CCC[C@H]1CCC[C@@H]1C(=O)NCC1(NC(=O)c2cc(C)ncn2)CCCCCC1
|
CCC[C@H]CCC[C@@H]5C=O)NCCNC=O)cccC)ncn6))))))))CCCCCC7
|
[C][C][C][C@H1][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][C][=N][Ring1][#Branch1][C][C][C][C][C][C][Ring1][P]
|
C16%10CCCCCC1.c17cc(C)ncn1.[C@H]19CCC[C@@H]18.CCC9.C38=O.C47=O.N35.C5%10.N46
|
C[C@@H]1CN(C(=O)CCn2cnnn2)C[C@@H]1CNC(=O)C1(N=[N+]=[N-])CCOCC1
|
C[C@@H]CNC=O)CCncnnn5))))))))C[C@@H]5CNC=O)CN=[N+]=[N-])))CCOCC6
|
[C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][C][=N][N][=N][Ring1][Branch1][C][C@@H1][Ring1][=C][C][N][C][=Branch1][C][=O][C][Branch1][Ring2][N][=N+1][=N-1][C][C][O][C][C][Ring1][=Branch2]
|
C16(N=[N+]=[N-])CCOCC1.C[C@@H]1CN3C[C@@H]18.C3(=O)CC7.n17cnnn1.C46=O.C58.N45
|
CN1CCc2ccc(C(=O)N3[C@@H]4CC[C@H]3C[C@H](NC(=O)[C@@]3(O)CCOC3)C4)cc21
|
CNCCccccC=O)N[C@@H]CC[C@H]5C[C@H]NC=O)[C@@]O)CCOC5)))))))C7)))))))))cc69
|
[C][N][C][C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][O][C][Ring1][=Branch1][C][Ring1][S][C][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][N]
|
CN1CCc2ccc9cc21.N15[C@@H]2CC[C@H]1C[C@H]7C2.[C@]18(O)CCOC1.C59=O.C68=O.N67
|
Cc1oc(C2CC2)nc1C(=O)NC1CC2(C1)CN(C(=O)Cc1ncn(C)c1C)C2
|
CcocCCC3)))nc5C=O)NCCCC4)CNC=O)CcncnC)c5C))))))))C4
|
[C][C][O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch1][P][C][=Branch1][C][=O][C][C][N][=C][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][Ring1][#C]
|
C15CC2(C1)CN4C2.Cc1oc8nc16.c17ncn(C)c1C.C4(=O)C7.C18CC1.C36=O.N35
|
N#Cc1ccc2[nH]cc(C(=O)NCCc3cccc4c3NCCC4)c2c1
|
N#Ccccc[nH]ccC=O)NCCcccccc6NCCC6))))))))))))))c5c9
|
[N][#C][C][=C][C][=C][NH1][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2]
|
N#Cc1ccc2[nH]cc7c2c1.c18cccc2c1NCCC2.C57=O.C6C8.N56
|
CC(C)(CNC(=O)C[C@@H]1NC(=O)NC1=O)CC1CN(C(=O)CC(F)(F)C(F)F)C1
|
CCC)CNC=O)C[C@@H]NC=O)NC5=O))))))))))CCCNC=O)CCF)F)CF)F)))))C4
|
[C][C][Branch1][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][N][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F][C][Ring1][=N]
|
C3(=O)CC(F)(F)C(F)F.[C@@H]15NC(=O)NC1=O.CC(C)(C4)C6.C16CN3C1.C2(=O)C5.N24
|
CCOC(=O)[C@@]1(C(=O)NCCCCn2cc(-c3nn(C)cc3Cl)nn2)CC12CC2
|
CCOC=O)[C@@]C=O)NCCCCncc-cnnC)cc5Cl))))))nn5)))))))))))CC3CC3
|
[C][C][O][C][=Branch1][C][=O][C@@][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][N][C][=C][Branch1][N][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][Cl][N][=N][Ring1][N][C][C][Ring2][Ring1][=Branch1][C][C][Ring1][Ring1]
|
c1%11nn(C)cc1Cl.[C@]189CC12CC2.n1%10cc%11nn1.C7CCC%10.C48=O.C59=O.CC6.O46.N57
|
C=CC[C@H](CC)C(=O)NCC(C)(C)[C@H]1CCCN1C(=O)C1CC2(C1)OCCO2
|
C=CC[C@H]CC))C=O)NCCC)C)[C@H]CCCN5C=O)CCCC4)OCCO5
|
[C][=C][C][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][Branch1][Ring2][C][Ring1][Ring2][O][C][C][O][Ring1][=Branch1]
|
C=CC[C@H](CC)C3=O.C16CC2(C1)OCCO2.[C@H]17CCCN14.C5C7(C)C.C46=O.N35
|
Cc1ccccc1C(F)(F)C(=O)NCC[C@@H](C)N(C)C(=O)CC(F)(F)C(F)(F)F
|
Ccccccc6CF)F)C=O)NCC[C@@H]C)NC)C=O)CCF)F)CF)F)F
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)CC(F)(F)C(F)(F)F.Cc1ccccc16.C6(F)(F)C2=O.C4C[C@H]5C.N35C.N24
|
CC1=C(C(=O)N2CC[C@@H](C)C[C@H]2CNC(=O)c2c(F)cc(C)cc2Cl)CCO1
|
CC=CC=O)NCC[C@@H]C)C[C@H]6CNC=O)ccF)ccC)cc6Cl)))))))))))))))))CCO5
|
[C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][Branch1][C][C][C][=C][Ring1][Branch2][Cl][C][C][O][Ring2][Ring1][O]
|
c16c(F)cc(C)cc1Cl.CC1=C(C3=O)CCO1.N13CC[C@@H](C)C[C@H]17.C46=O.C57.N45
|
CC[C@H]1CN(C(=O)C=Cc2cn(C)cn2)C[C@@H]1C(=O)NC1CCN(C(N)=O)CC1
|
CC[C@H]CNC=O)C=CccnC)cn5))))))))C[C@@H]5C=O)NCCCNCN)=O))CC6
|
[C][C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][N][Branch1][C][C][C][=N][Ring1][=Branch1][C][C@@H1][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2]
|
[C@H]19CN3C[C@@H]17.C=8c1cn(C)cn1.C16CCN5CC1.C3(=O)C=8.C47=O.C5(N)=O.CC9.N46
|
CC(=CC(=O)N1C[C@H](NC(=O)c2ncnc(O)c2F)[C@@H](C(F)F)C1)c1cccs1
|
CC=CC=O)NC[C@H]NC=O)cncncO)c6F)))))))))[C@@H]CF)F))C5)))))))ccccs5
|
[C][C][=Branch2][Ring2][=Branch2][=C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=N][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][F][C@@H1][Branch1][=Branch1][C][Branch1][C][F][F][C][Ring2][Ring1][Ring1][C][=C][C][=C][S][Ring1][Branch1]
|
c16ncnc(O)c1F.CC=7c1cccs1.N13C[C@H]5[C@@H]8C1.C=7C3=O.C46=O.C8(F)F.N45
|
NC(=O)[C@]1(O)CCN(C(=O)[C@@]23CCC[C@H]2CCN3C(=O)[C@H]2CCCC(=O)N2)C1
|
NC=O)[C@]O)CCNC=O)[C@@]CCC[C@H]5CCN8C=O)[C@H]CCCC=O)N6))))))))))))))))C5
|
[N][C][=Branch1][C][=O][C@][Branch1][C][O][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@@][C][C][C][C@H1][Ring1][Branch1][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C@H1][C][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][Ring2][Ring1][=Branch2]
|
[C@@]126CCC[C@H]1CCN25.[C@@]18(O)CCN4C1.[C@H]17CCCC(=O)N1.NC8=O.C46=O.C57=O
|
CCC1(C(=O)N[C@H]2CN(C(=O)c3cc(COC)no3)CC3(CCC3)C2)CCC1
|
CCCC=O)N[C@H]CNC=O)cccCOC)))no5))))))CCCCC4)))C6))))))))CCC4
|
[C][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][Ring2][C][O][C][=N][O][Ring1][Branch2][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Ring1][C][C][C][Ring2][Ring1][#Branch2]
|
[C@H]17CN5CC2(CCC2)C1.c18cc%10no1.C19%11CCC1.C49=O.C58=O.CC%11.N47.C6%10.O6C
|
C=CCn1cc(NC(=O)[C@@]2(C)CN(C(=O)C3C4(CC4)C34CC4)C(C)(C)C2)cn1
|
C=CCnccNC=O)[C@@]C)CNC=O)CCCC3))C3CC3))))))CC)C)C5)))))))cn5
|
[C][=C][C][N][C][=C][Branch2][Ring2][N][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][Branch1][C][C][Ring1][Ring1][C][Branch1][C][C][Branch1][C][C][C][Ring1][P][C][=N][Ring2][Ring1][=Branch2]
|
[C@]18(C)CN6C(C)(C)C1.C19C2(CC2)C12CC2.n1%10cc7cn1.C=CC%10.C58=O.C69=O.N57
|
Cc1cscc1C(=O)NC[C@]1(F)C[C@@H](NC(=O)COC[C@@H](C)N2CCCC2)C1
|
Cccscc5C=O)NC[C@]F)C[C@@H]NC=O)COC[C@@H]C)NCCCC5)))))))))))C4
|
[C][C][=C][S][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][O][C][C@@H1][Branch1][C][C][N][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][C]
|
Cc1cscc1%10.[C@]1%11(F)C[C@H]9C1.N18CCCC1.C4(=O)C5.C6[C@H]8C.C3%10=O.N37.C7%11.N49.O56
|
Nc1cc(F)c(Cl)cc1C(=O)N[C@@H]1[C@H]2CCCCN(C(=O)C34CC(F)(C3)C4)[C@H]21
|
NcccF)cCl)cc6C=O)N[C@@H][C@H]CCCCNC=O)CCCF)C4)C4)))))[C@H]78
|
[N][C][=C][C][Branch1][C][F][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][=Branch1][C@H1][Ring1][#C][Ring1][S]
|
Nc1cc(F)c(Cl)cc19.[C@@H]17[C@H]2CCCCN6[C@@H]12.C128CC(F)(C1)C2.C59=O.C68=O.N57
|
O=C(Nc1cc(CSCCO)ccn1)[C@@]1(C(F)F)CCCO1
|
O=CNcccCSCCO)))))ccn6)))))))[C@@]CF)F))CCCO5
|
[O][=C][Branch1][P][N][C][=C][C][Branch1][=Branch1][C][S][C][C][O][=C][C][=N][Ring1][O][C@@][Branch1][=Branch1][C][Branch1][C][F][F][C][C][C][O][Ring1][Branch2]
|
c15cc8ccn1.[C@]167CCCO1.O=C26.C4CO.C7(F)F.N25.C38.S34
|
CC(C)(C)c1cc(C(=O)N[C@H]2C[C@@](C)(NC(=O)Cc3sc(O)nc3O)C2)cs1
|
CCC)C)cccC=O)N[C@H]C[C@@]C)NC=O)CcscO)nc5O)))))))))C4))))))cs5
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@H1][C][C@@][Branch1][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][S][C][Branch1][C][O][=N][C][=Ring1][=Branch1][O][C][Ring1][S][=C][S][Ring2][Ring1][Branch2]
|
c1%10sc(O)nc1O.c19cc8cs1.[C@H]17C[C@]6(C)C1.CC9(C)C.C5(=O)C%10.C48=O.N47.N56
|
CC(C)OC(C)(C)C(=O)N(CCNC(=O)C1(c2ccnc(Cl)c2)CCC1)C1CC1
|
CCC)OCC)C)C=O)NCCNC=O)CcccncCl)c6))))))CCC4))))))))CCC3
|
[C][C][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][O][C][C][N][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][C][Ring1][O][C][C][C][Ring1][Ring1]
|
c1%11ccnc(Cl)c1.C6(C)(C)C3=O.C1%10%11CCC1.CC5C.N379.C7C8.C4%10=O.C19CC1.O56.N48
|
CCn1nnnc1[C@@H](NCCOC1CC1)C1CC(C)(C)OC(C)(C)C1
|
CCnnnnc5[C@@H]NCCOCCC3)))))))CCCC)C)OCC)C)C6
|
[C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][#Branch2][N][C][C][O][C][C][C][Ring1][Ring1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2]
|
C18CC(C)(C)OC(C)(C)C1.n16nnnc17.[C@@H]478.C5C2.C13CC1.CC6.N45.O23
|
O=C(C=C1CCCCC1)N[C@@H]1C[C@H]2CC[C@@]1(NC(=O)Cc1c[nH]nc1O)C2
|
O=CC=CCCCCC6)))))))N[C@@H]C[C@H]CC[C@@]6NC=O)Ccc[nH]nc5O)))))))))C5
|
[O][=C][Branch1][#Branch2][C][=C][C][C][C][C][C][Ring1][=Branch1][N][C@@H1][C][C@H1][C][C][C@@][Ring1][=Branch1][Branch1][#C][N][C][=Branch1][C][=O][C][C][=C][NH1][N][=C][Ring1][Branch1][O][C][Ring1][#C]
|
[C@@H]15C[C@H]2CC[C@@]16C2.C1=7CCCCC1.c18c[nH]nc1O.O=C3C=7.C4(=O)C8.N35.N46
|
CN1C[C@H](C(=O)N[C@H](CC(=O)N2CC(O)(C(F)(F)F)C2)C(F)(F)F)CC1=O
|
CNC[C@H]C=O)N[C@H]CC=O)NCCO)CF)F)F))C4))))))CF)F)F)))))CC5=O
|
[C][N][C][C@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][=Branch2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring2][Ring1][=Branch2][=O]
|
[C@@H]5(CC4=O)C(F)(F)F.CN1C[C@H]6CC1=O.N14CC7(O)C1.C7(F)(F)F.C36=O.N35
|
CC(=O)c1ccsc1C(=O)N[C@H]1[C@@H]2CN(C(=O)c3ccc(F)cc3)C[C@@H]21
|
CC=O)cccsc5C=O)N[C@H][C@@H]CNC=O)ccccF)cc6)))))))C[C@@H]56
|
[C][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C@@H1][Ring1][=C][Ring1][#C]
|
[C@@H]16[C@H]2CN5C[C@@H]12.c19ccc(F)cc1.c18ccsc17.CC8=O.C47=O.C59=O.N46
|
C[C@H]1CCO[C@H](C(=O)NC2(C)CN(C(=O)[C@H](C)C3(O)CCC3)C2)C1
|
C[C@H]CCO[C@H]C=O)NCC)CNC=O)[C@H]C)CO)CCC4))))))C4))))))C6
|
[C][C@H1][C][C][O][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][Ring1][=C][C][Ring2][Ring1][#Branch1]
|
C[C@H]1CCO[C@H]7C1.C16(C)CN5C1.C5(=O)[C@@H]8C.C18(O)CCC1.C47=O.N46
|
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