SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
CC(=O)OCCC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@H](NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C)C2
|
CC=O)OCCC=O)N[C@H]CC[C@H]5[C@H]C)[C@H]NC=O)[C@@H]C[C@@H]3[C@@H]C[C@H]3C)))))))))C7
|
[C][C][=Branch1][C][=O][O][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C@H1][Branch1][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C@@H1][C][C@H1][Ring1][Ring1][C][C][Ring2][Ring1][C]
|
N14[C@H]2CC[C@H]1[C@H](C)[C@H]7C2.[C@@H]18C[C@@H]1[C@@H]1C[C@H]1C.C6CC4=O.CC3=O.C58=O.O36.N57
|
CP(C)(=O)CC(=O)N1CCN(C(=O)c2occ3c2CCC3)[C@H](CO)C1
|
CPC)=O)CC=O)NCCNC=O)coccc5CCC5)))))))))[C@H]CO))C6
|
[C][P][Branch1][C][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][C][C][Ring1][Branch1][C@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][C]
|
N14CCN5[C@H]7C1.c16occ2c1CCC2.CP(C)(=O)CC4=O.C56=O.C7O
|
Cc1ccccc1O[C@@H](C)CN=C(NCC(=O)NC(C)C)NCC1CC=CC1
|
Ccccccc6O[C@@H]C)CN=CNCC=O)NCC)C))))))NCCCC=CC5
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C@@H1][Branch1][C][C][C][N][=C][Branch1][=N][N][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][C][C][C][C][=C][C][Ring1][Branch1]
|
[C@H]3(C)CN=C(N5)N7.Cc1ccccc14.C18CC=CC1.C5C2=O.C6(C)C.O34.N26.C78
|
C[C@H](CSc1ccccc1)C(=O)N1C[C@@H](NC(=O)CCCCC2CC2)CC1(C)C
|
C[C@H]CScccccc6))))))))C=O)NC[C@@H]NC=O)CCCCCCC3)))))))))CC5C)C
|
[C][C@H1][Branch1][O][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][Ring1][C][C][Ring1][#C][Branch1][C][C][C]
|
N13C[C@@H]6CC1(C)C.C4(=O)CCCC7.C[C@H](C5)C3=O.c18ccccc1.C17CC1.S58.N46
|
O=C([C@@H]1CCCCCCN1C(=O)c1ncncc1Cl)N1CCO[C@H](CC2CC2)C1
|
O=C[C@@H]CCCCCCN8C=O)cncncc6Cl))))))))))))))))NCCO[C@H]CCCC3))))C6
|
[O][=C][Branch2][Ring1][Branch2][C@@H1][C][C][C][C][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][=N][C][=N][C][=C][Ring1][=Branch1][Cl][N][C][C][O][C@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][#Branch2]
|
[C@@H]15CCCCCCN14.c16ncncc1Cl.N13CCO[C@H]7C1.O=C35.C46=O.C18CC1.C78
|
NC(=O)c1ccc(CC(=O)N2C[C@H]3CCC[C@@]3(NC(=O)Cc3cc[nH]n3)C2)cn1
|
NC=O)ccccCC=O)NC[C@H]CCC[C@@]5NC=O)Cccc[nH]n5))))))))C8))))))))))cn6
|
[N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@][Ring1][Branch1][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][=C][NH1][N][=Ring1][Branch1][C][Ring1][P][C][=N][Ring2][Ring1][#Branch2]
|
N14C[C@H]2CCC[C@@]26C1.c17ccc9cn1.c18cc[nH]n1.C9C4=O.C5(=O)C8.NC7=O.N56
|
Cc1cc(F)cc([C@@H](C)C(=O)N[C@@H](C)CN(C)C(=O)CCN2CCOC2=O)c1
|
CcccF)cc[C@@H]C)C=O)N[C@@H]C)CNC)C=O)CCNCCOC5=O)))))))))))))))c6
|
[C][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring1][P][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][C][C][O][C][Ring1][Branch1][=O][=C][Ring2][Ring1][O]
|
Cc1cc8cc(F)c1.N17CCOC1=O.[C@H]8(C)C3=O.C4(=O)CC7.[C@H]5(C)C6.N46C.N35
|
CC[C@H](CNC(=O)CCCn1ccnc1)NC(=O)c1cc(Cl)nc(N(C)C)c1
|
CC[C@H]CNC=O)CCCnccnc5)))))))))))NC=O)cccCl)ncNC)C))c6
|
[C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C][N][C][=C][N][=C][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][C][Branch1][=Branch1][N][Branch1][C][C][C][=C][Ring1][#Branch2]
|
c17cc6nc(Cl)c1.C2(=O)CCC8.CC[C@@H]4C5.n18ccnc1.C37=O.N6(C)C.N25.N34
|
CC(C)[C@H](C(=O)NC[C@H]1CC[C@H]1C(=O)N(C)C[C@H](O)C1CCCC1)C1CCC1
|
CCC)[C@H]C=O)NC[C@H]CC[C@H]4C=O)NC)C[C@H]O)CCCCC5))))))))))))))))CCCC4
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][O][C][C][C][C][C][Ring1][Branch1][C][C][C][C][Ring1][Ring2]
|
CC(C)[C@@H]7C2=O.[C@H]18CC[C@H]16.C19CCCC1.C5[C@@H]9O.C17CCC1.C36=O.N35C.N24.C48
|
FC(F)(F)SCCCNC1CC(Oc2ccccc2)C1
|
FCF)F)SCCCNCCCOcccccc6)))))))C4
|
[F][C][Branch1][C][F][Branch1][C][F][S][C][C][C][N][C][C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O]
|
c14ccccc1.FC(F)(F)S6.C17CC3C1.C6CC5.N57.O34
|
Cc1cc(CC(=O)N2CCN(C(=O)[C@@H]3CC34CCSCC4)C[C@H]2CO)n[nH]1
|
CcccCC=O)NCCNC=O)[C@@H]CC3CCSCC6)))))))))C[C@H]6CO))))))))))n[nH]5
|
[C][C][=C][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][S][C][C][Ring1][=Branch1][C][C@H1][Ring1][S][C][O][=N][NH1][Ring2][Ring1][#Branch2]
|
N15CCN6C[C@H]18.[C@@H]17CC12CCSCC2.Cc1cc9n[nH]1.C9C5=O.C67=O.C8O
|
CC(C)SCC(=O)N1CCC(F)(F)[C@H](CNC(=O)C(F)=CC2CC2)C1
|
CCC)SCC=O)NCCCF)F)[C@H]CNC=O)CF)=CCCC3))))))))C6
|
[C][C][Branch1][C][C][S][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][Branch1][C][F][=C][C][C][C][Ring1][Ring1][C][Ring2][Ring1][C]
|
N13CCC(F)(F)[C@H]9C1.C4(=O)C=8F.C7C3=O.C=8C1CC1.CC6C.S67.C59.N45
|
CCc1ccc(C(=O)N[C@@H]2CCN(C(=O)C=CCOCCOC)C[C@H]2CO)cn1
|
CCccccC=O)N[C@@H]CCNC=O)C=CCOCCOC)))))))))C[C@H]6CO))))))))))cn6
|
[C][C][C][=C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][O][C][C][O][C][C][C@H1][Ring1][S][C][O][C][=N][Ring2][Ring1][O]
|
[C@@H]19CCN5C[C@H]14.c1%12ccc%10cn1.C5(=O)C=%11.C3%10=O.C=%11C6.C7C8.CC%12.N39.O67.O8C.C4O
|
C[C@H]1CCOCCN1C(=O)C1=CCN(C(=O)c2ccccc2O)CC1
|
C[C@H]CCOCCN7C=O)C=CCNC=O)cccccc6O))))))))CC6
|
[C][C@H1][C][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring1][#C]
|
C3(=O)C1=CCN4CC1.C[C@H]1CCOCCN13.c15ccccc1O.C45=O
|
C[C@@H](OCCN(C)C)C(=O)N1CCN(C(=O)c2ccc(F)o2)CC12CCC2
|
C[C@@H]OCCNC)C)))))C=O)NCCNC=O)ccccF)o5))))))CC6CCC4
|
[C][C@@H1][Branch1][=Branch2][O][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][O][Ring1][=Branch1][C][C][Ring1][=C][C][C][C][Ring1][Ring2]
|
N13CCN4CC12CCC2.c18ccc(F)o1.C[C@@H]5C3=O.C6C7.N7(C)C.C48=O.O56
|
C=C[C@@H](C(=O)NC1(CO)CCN(C(=O)C[C@]2(C)CCCO2)CC1)c1ccccc1
|
C=C[C@@H]C=O)NCCO))CCNC=O)C[C@]C)CCCO5)))))))CC6))))))))cccccc6
|
[C][=C][C@@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C@][Branch1][C][C][C][C][C][O][Ring1][=Branch1][C][C][Ring1][P][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C157CCN4CC1.C=C[C@H]8C3=O.[C@@]16(C)CCCO1.c18ccccc1.C4(=O)C6.N35.C7O
|
CCc1cc(C(=O)N2CC(F)(CNC(=O)c3c(Cl)cnn3CC)C2)n(C)n1
|
CCcccC=O)NCCF)CNC=O)ccCl)cnn5CC))))))))))C4)))))nC)n5
|
[C][C][C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=N][N][Ring1][=Branch1][C][C][C][Ring1][P][N][Branch1][C][C][N][=Ring2][Ring1][=Branch2]
|
c1%10cc7n(C)n1.c18c(Cl)cnn19.N14CC%11(F)C1.C47=O.C58=O.CC%10.C6%11.N56.C9C
|
CO[C@H]1C[C@H](NC(=O)N[C@H](C)c2ccn(C)n2)CN(C(=O)OC(C)(C)C)C1
|
CO[C@H]C[C@H]NC=O)N[C@H]C)cccnC)n5)))))))))CNC=O)OCC)C)C))))C6
|
[C][O][C@H1][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][=Branch2]
|
[C@H]18C[C@H]%10CN6C1.c1%11ccn(C)n1.C7(C)(C)C.C45=O.[C@H]9%11C.C36=O.CO8.N4%10.N59.O37
|
COc1cc(CN2CCN(CC(=O)N3CCc4cnccc4C3)CC2)ccc1Cl
|
COcccCNCCNCC=O)NCCccnccc6C%10))))))))))))CC6)))))))ccc6Cl
|
[C][O][C][=C][C][Branch2][Ring1][P][C][N][C][C][N][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C][C][C][=C][N][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring1][=C][C][=C][Ring2][Ring1][#Branch2][Cl]
|
N15CCc2cnccc2C1.c16cc9ccc1Cl.N17CCN8CC1.C8C5=O.CO6.C79
|
CC(C)C[C@@H](CNC(=O)c1ccc(F)c(O)c1F)NC(=O)C(C)(C)[C@@H]1CCCO1
|
CCC)C[C@@H]CNC=O)ccccF)cO)c6F))))))))))NC=O)CC)C)[C@@H]CCCO5
|
[C][C][Branch1][C][C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][O][=C][Ring1][Branch2][F][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][C][O][Ring1][Branch1]
|
c16ccc(F)c(O)c1F.CC(C)C[C@H]4C5.C3(=O)C7(C)C.[C@@H]17CCCO1.C26=O.N25.N34
|
COC(=O)[C@H]1CC=CC[C@H]1C(=O)N[C@@H]1CCN(C(=O)c2ccccc2C(N)=O)C1
|
COC=O)[C@H]CC=CC[C@H]6C=O)N[C@@H]CCNC=O)cccccc6CN)=O)))))))))C5
|
[C][O][C][=Branch1][C][=O][C@H1][C][C][=C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][C][Ring1][S]
|
[C@H]17CC=CC[C@H]18.c19ccccc1%10.[C@@H]16CCN5C1.C37=O.C48=O.C59=O.C%10(N)=O.CO3.N46
|
Cc1nn(C2CC2)cc1C(=O)N1CCC2(CCN(C(=O)C(=O)NC(C)C)CC2)C1
|
CcnnCCC3)))cc5C=O)NCCCCCNC=O)C=O)NCC)C)))))CC6)))))C5
|
[C][C][=N][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][C][Ring1][=C][C][Ring2][Ring1][C]
|
N13CCC2(CCN4CC2)C1.Cc1nn8cc17.C4(=O)C5=O.C18CC1.C37=O.C6(C)C.N56
|
CCCc1noc2nc(CC)cc(C(=O)N[C@@H](C)[C@@H](CO)NC(C)=O)c12
|
CCCcnocncCC))ccC=O)N[C@@H]C)[C@@H]CO))NCC)=O)))))))c96
|
[C][C][C][C][=N][O][C][=N][C][Branch1][Ring1][C][C][=C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@@H1][Branch1][Ring1][C][O][N][C][Branch1][C][C][=O][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][Ring2]
|
c18noc2nc9cc7c12.[C@H]5(C)[C@H]6CO.CCC8.C37=O.C4(C)=O.C9C.N35.N46
|
Cn1ncc(C#N)c1C(=O)N[C@H]1CC[C@@H](N2CCN(C(=O)/C(Cl)=C/Cl)CC2)C1
|
CnnccC#N))c5C=O)N[C@H]CC[C@@H]NCCNC=O)/CCl)=C/Cl))))CC6))))))C5
|
[C][N][N][=C][C][Branch1][Ring1][C][#N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][C][N][Branch1][O][C][=Branch1][C][=O][/C][Branch1][C][Cl][=C][/Cl][C][C][Ring1][N][C][Ring1][P]
|
Cn1ncc(C#N)c17.N16CCN4CC1.[C@H]15CC[C@@H]6C1.C4(=O)/C(Cl)=C/Cl.C37=O.N35
|
C[C@H](CC(C)(C)CO)NC(=O)CCCN(C)C(=O)C(=O)C(C)(C)C
|
C[C@H]CCC)C)CO))))NC=O)CCCNC)C=O)C=O)CC)C)C
|
[C][C@H1][Branch1][O][C][C][Branch1][C][C][Branch1][C][C][C][O][N][C][=Branch1][C][=O][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C]
|
C[C@@H]3CC(C)(C)CO.C2(=O)C(=O)C(C)(C)C.C1(=O)CCC4.N24C.N13
|
Cc1cnccc1[C@@H](C)C(=O)N1CC2(CNC(=O)COC(C)C)CCC1CC2
|
Cccnccc6[C@@H]C)C=O)NCCCNC=O)COCC)C)))))))CCC6CC6
|
[C][C][=C][N][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][=C][C][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][C][C][C][C][Ring1][#C][C][C][Ring1][#C]
|
N13CC28CCC1CC2.Cc1cnccc19.[C@H]9(C)C3=O.C4(=O)C5.C6(C)C.C78.N47.O56
|
CC[C@@](C)(CNC(=O)c1cnn(C)c1)NC(=O)CCCn1nc(C)nc1C
|
CC[C@@]C)CNC=O)ccnnC)c5))))))))NC=O)CCCnncC)nc5C
|
[C][C][C@@][Branch1][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][N][N][=C][Branch1][C][C][N][=C][Ring1][=Branch1][C]
|
n17nc(C)nc1C.CC[C@@]4(C)C5.c16cnn(C)c1.C3(=O)CCC7.C26=O.N25.N34
|
CCOCC(C)(C)NC(=O)C1CC(CCNC(=O)CCNC(=O)CO)C1
|
CCOCCC)C)NC=O)CCCCCNC=O)CCNC=O)CO))))))))))C4
|
[C][C][O][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][P][C][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][O][C][Ring1][S]
|
C7C8(C)C.C1%11CC3C1.C4(=O)CC%10.C5(=O)CO.C2%11=O.C3C9.CC6.O67.N28.N49.N5%10
|
Cc1ccc2sc([C@H](C(=O)NCC3CC3)N(C)[C@H](C)C3CC3)cc2c1
|
Cccccsc[C@H]C=O)NCCCC3))))))NC)[C@H]C)CCC3))))))cc5c9
|
[C][C][=C][C][=C][S][C][Branch2][Ring1][N][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][N][Branch1][C][C][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][=C][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2]
|
Cc1ccc2sc8cc2c1.[C@@H]58C4=O.C19CC1.N57C.[C@H]7%10C.C1%10CC1.N46.C69
|
CSc1ccc([C@H](C)N[C@@H]2CCCN(c3ccccc3)C2)cc1
|
CScccc[C@H]C)N[C@@H]CCCNcccccc6))))))C6))))))))cc6
|
[C][S][C][=C][C][=C][Branch2][Ring1][Branch2][C@H1][Branch1][C][C][N][C@@H1][C][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][C][=C][Ring2][Ring1][Branch1]
|
c18ccc7cc1.[C@@H]16CCCN5C1.c15ccccc1.[C@@H]47C.CS8.N46
|
COCc1cc(C(=O)NC2CC3(C2)CC(NC(=O)C2(C#N)C[C@H]4C[C@@H]4C2)C3)n[nH]1
|
COCcccC=O)NCCCC4)CCNC=O)CC#N))C[C@H]C[C@@H]3C6))))))))C4))))))))n[nH]5
|
[C][O][C][C][=C][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C@H1][C][C@@H1][Ring1][Ring1][C][Ring1][Branch2][C][Ring1][S][=N][NH1][Ring2][Ring1][#Branch2]
|
C18CC2(C1)CC9C2.C1%11(C#N)C[C@H]2C[C@@H]2C1.c1%12cc%10n[nH]1.C5%10=O.C6%11=O.CO7.C7%12.N58.N69
|
Cc1nc(O)c(C(=O)NC[C@@]2(F)CCN(C(=O)c3cc4[nH]ccc4s3)C2)nc1C
|
CcncO)cC=O)NC[C@@]F)CCNC=O)ccc[nH]ccc5s8)))))))))C5))))))))nc6C
|
[C][C][=N][C][Branch1][C][O][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][F][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][NH1][C][=C][C][=Ring1][Branch1][S][Ring1][Branch2][C][Ring1][S][N][=C][Ring2][Ring1][O][C]
|
Cc1nc(O)c8nc1C.c19cc2[nH]ccc2s1.[C@]1%10(F)CCN6C1.C58=O.C69=O.N57.C7%10
|
C[C@@H](NC(=O)[C@H]1CCOC1)C1(O)CN(C(=O)c2ccc3ccc(Cl)cc3n2)C1
|
C[C@@H]NC=O)[C@H]CCOC5)))))))CO)CNC=O)cccccccCl)cc6n%10)))))))))))C4
|
[C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][C][O][C][Ring1][Branch1][C][Branch1][C][O][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][Branch1][C][Cl][=C][C][Ring1][#Branch1][=N][Ring1][O][C][Ring2][Ring1][C]
|
c17ccc2ccc(Cl)cc2n1.C19(O)CN5C1.[C@H]18CCOC1.C[C@@H]69.C48=O.C57=O.N46
|
CO[C@@H]1CN(C(=O)CC2(O)CCOCC2)C[C@@H]1NC(=O)[C@@]1(O)CC1(C)C
|
CO[C@@H]CNC=O)CCO)CCOCC6))))))))C[C@@H]5NC=O)[C@@]O)CC3C)C
|
[C][O][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][O][C][C][Ring1][#Branch1][C][C@@H1][Ring1][#C][N][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][Ring1][Ring2][Branch1][C][C][C]
|
[C@@H]15CN3C[C@@H]16.C18(O)CCOCC1.[C@]17(O)CC1(C)C.C3(=O)C8.C47=O.CO5.N46
|
C#C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2C2CC2)CCN1C(=O)C1CC2(CC2)C1
|
C#C[C@@H]CNC=O)[C@H]C[C@@H]3CCC3)))))))CCN6C=O)CCCCC3))C4
|
[C][#C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][Ring1][Ring1][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=Branch1]
|
C#C[C@@H]1CN3CCN14.[C@H]15C[C@@H]1C1CC1.C16CC2(CC2)C1.C35=O.C46=O
|
CO[C@@H](CCS(C)(=O)=O)CN1CC(=O)N(CCNC(=O)c2cc[nH]n2)C1=O
|
CO[C@@H]CCSC)=O)=O))))CNCC=O)NCCNC=O)ccc[nH]n5)))))))))C5=O
|
[C][O][C@@H1][Branch1][O][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][N][C][C][=Branch1][C][=O][N][Branch1][#C][C][C][N][C][=Branch1][C][=O][C][C][=C][NH1][N][=Ring1][Branch1][C][Ring1][S][=O]
|
[C@@H]4(C7)CCS(C)(=O)=O.N17CC(=O)N8C1=O.c16cc[nH]n1.C8C5.C36=O.CO4.N35
|
CN(CC(CO)(CO)NC(=O)C=Cc1ccccc1F)C(=O)CCCCC(N)=O
|
CNCCCO))CO))NC=O)C=Ccccccc6F)))))))))))))C=O)CCCCCN)=O
|
[C][N][Branch2][Ring1][O][C][C][Branch1][Ring1][C][O][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][C][C][C][C][C][Branch1][C][N][=O]
|
C3(=O)CCCCC(N)=O.C=6c1ccccc1F.C4C5(CO)CO.C2(=O)C=6.CN34.N25
|
COC(C)(C)CC(=O)NC[C@H]1C[C@@H](NC(=O)CCO[C@H]2CCOC2)C1
|
COCC)C)CC=O)NC[C@H]C[C@@H]NC=O)CCO[C@H]CCOC5))))))))))C4
|
[C][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][O][C@H1][C][C][O][C][Ring1][Branch1][C][Ring1][#C]
|
C5(C)(C)CC3=O.[C@H]1%10C[C@@H]9C1.C4(=O)CC6.[C@H]17CCOC1.CO5.N38.C8%10.N49.O67
|
COCC1(NC(=O)c2cncc(F)c2)CN(C(=O)c2c[nH]c3cc(F)ccc23)C1
|
COCCNC=O)ccnccF)c6))))))))CNC=O)cc[nH]cccF)ccc96))))))))))C4
|
[C][O][C][C][Branch1][P][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][Ring2][Ring1][#Branch2]
|
c19c[nH]c2cc(F)ccc12.c18cncc(F)c1.C17%10CN5C1.C48=O.C59=O.CO6.C6%10.N47
|
C[C@H](O)CC(=O)N1CC[C@@H](NC(=O)c2cccc3c2OCC3)C1(C)C
|
C[C@H]O)CC=O)NCC[C@@H]NC=O)cccccc6OCC5)))))))))))C5C)C
|
[C][C@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring1][Branch1][C][Ring1][P][Branch1][C][C][C]
|
c17cccc2c1OCC2.N14CC[C@@H]6C1(C)C.C[C@H](O)CC4=O.C57=O.N56
|
CCc1cc(C(F)(F)F)ccc1C(=O)NC[C@H]1C[C@H]1NC(=O)Cc1cnn(C)c1
|
CCcccCF)F)F))ccc6C=O)NC[C@H]C[C@H]3NC=O)CccnnC)c5
|
[C][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
c18cc9ccc16.c1%10cnn(C)c1.C9(F)(F)F.[C@H]17C[C@H]15.C3(=O)C%10.C26=O.CC8.N24.C47.N35
|
C/C=C/C[C@H](NC(=O)C1=CCCC[C@H]1C)C(=O)N[C@H](CCC)C1CC1
|
C/C=C/C[C@H]NC=O)C=CCCC[C@H]6C)))))))))C=O)N[C@H]CCC)))CCC3
|
[C][/C][=C][/C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][C][C][C][C@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring2][C][C][C][C][C][C][Ring1][Ring1]
|
C2(=O)C1=CCCC[C@H]1C.C=6C[C@H]4C3=O.[C@H]57CCC.C17CC1.CC=6.N24.N35
|
CCCCn1nccc1C(=O)NC[C@]1(C)CCN(C(=O)[C@H](F)C[C@@H]2CCOC2)C1
|
CCCCnnccc5C=O)NC[C@]C)CCNC=O)[C@H]F)C[C@@H]CCOC5))))))))C5
|
[C][C][C][C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring1][S]
|
[C@@]18(C)CCN4C1.n17nccc16.C4(=O)[C@H](F)C9.[C@@H]19CCOC1.CCCC7.C36=O.N35.C58
|
CCCc1nc(C(=O)NC[C@H]2CC[C@H]2NC(=O)c2snc(C)c2N)cs1
|
CCCcncC=O)NC[C@H]CC[C@H]4NC=O)csncC)c5N)))))))))))))))cs5
|
[C][C][C][C][=N][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][S][N][=C][Branch1][C][C][C][=Ring1][=Branch1][N][=C][S][Ring2][Ring1][#Branch1]
|
c18snc(C)c1N.c19nc7cs1.[C@H]1%10CC[C@H]16.CCC9.C37=O.C48=O.N35.C5%10.N46
|
CN(C[C@H]1CCCS1(=O)=O)S(=O)(=O)c1cc2cc(F)ccc2s1
|
CNC[C@H]CCCS5=O)=O)))))))S=O)=O)cccccF)ccc6s9
|
[C][N][Branch1][=N][C][C@H1][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2]
|
S4(=O)(=O)c1cc2cc(F)ccc2s1.[C@H]15CCCS1(=O)=O.CN34.C35
|
C[C@@H]1CCCN(C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CC23CCC3)[C@H]1CO
|
C[C@@H]CCCNC=O)[C@@H]CNC=O)OCC)C)C))))CC5CCC4)))))))))[C@H]6CO
|
[C][C@@H1][C][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][N][C][C][C][Ring1][Ring2][C@H1][Ring2][Ring1][#Branch1][C][O]
|
[C@@H]18CN6CC12CCC2.C[C@@H]1CCCN5[C@H]19.C7(C)(C)C.C58=O.C46=O.O47.C9O
|
CCC(O)(CC)c1cn([C@H]2C[C@@H](NC(=O)C3(C)CC(=O)C3)C2)nn1
|
CCCO)CC))ccn[C@H]C[C@@H]NC=O)CC)CC=O)C4))))))C4))))nn5
|
[C][C][C][Branch1][C][O][Branch1][Ring1][C][C][C][=C][N][Branch2][Ring1][O][C@H1][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=Branch1][C][=O][C][Ring1][=Branch1][C][Ring1][=N][N][=N][Ring2][Ring1][C]
|
CCC7(O)CC.c17cn8nn1.C16(C)CC(=O)C1.[C@H]18C[C@@H]5C1.C46=O.N45
|
Cc1cnc(NCCC#N)c(S(=O)(=O)N[C@H](C)c2ccc([S@@+](C)[O-])cc2)c1
|
CccncNCCC#N)))))cS=O)=O)N[C@H]C)cccc[S@@+]C)[O-]))cc6)))))))))c6
|
[C][C][=C][N][=C][Branch1][=Branch1][N][C][C][C][#N][C][Branch2][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=C][C][=C][Branch1][=Branch1][S@@+1][Branch1][C][C][O-1][C][=C][Ring1][=Branch2][=C][Ring2][Ring1][#Branch2]
|
Cc1cnc6c(S5(=O)=O)c1.c17ccc([S@@+](C)[O-])cc1.C3CC#N.[C@H]47C.N36.N45
|
C[C@H](CCC(=O)N(C)Cc1cnnn1C)NC(=O)C[C@H]1CCCN(C)C1
|
C[C@H]CCC=O)NC)Cccnnn5C)))))))))))NC=O)C[C@H]CCCNC)C6
|
[C][C@H1][Branch2][Ring1][Ring2][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][N][=N][N][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][N][Branch1][C][C][C][Ring1][#Branch1]
|
C[C@@H]4CCC2=O.[C@H]17CCCN(C)C1.c16cnnn1C.C3(=O)C7.N25C.C56.N34
|
Cc1c(C#N)c(=NCCCCCCCN2CCCC2)[nH]c2ccccc12
|
CccC#N))c=NCCCCCCCNCCCC5)))))))))))))[nH]cccccc%106
|
[C][C][=C][Branch1][Ring1][C][#N][C][=Branch1][S][=N][C][C][C][C][C][C][C][N][C][C][C][C][Ring1][Branch1][NH1][C][=C][C][=C][C][=C][Ring2][Ring1][=Branch2][Ring1][=Branch1]
|
Cc1c(C#N)c(=NCCCCCCC3)[nH]c2ccccc12.N13CCCC1
|
C=CCCN=C(NCc1ccc(OC)nc1)N1CC[C@H](C)[C@H]1C
|
C=CCCN=CNCccccOC))nc6))))))))NCC[C@H]C)[C@H]5C
|
[C][=C][C][C][N][=C][Branch1][#C][N][C][C][=C][C][=C][Branch1][Ring1][O][C][N][=C][Ring1][Branch2][N][C][C][C@H1][Branch1][C][C][C@H1][Ring1][=Branch1][C]
|
C=CCCN=C(N3)N1CC[C@H](C)[C@H]1C.c14ccc2nc1.C34.O2C
|
Cn1nnc(CNC(=O)[C@H](c2cnc[nH]2)N2CC[C@H]3NC(=O)CC[C@@H]3C2)n1
|
CnnncCNC=O)[C@H]ccnc[nH]5)))))NCC[C@H]NC=O)CC[C@@H]6C%10))))))))))))))n5
|
[C][N][N][=N][C][Branch2][Ring2][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][=C][N][=C][NH1][Ring1][Branch1][N][C][C][C@H1][N][C][=Branch1][C][=O][C][C][C@@H1][Ring1][#Branch1][C][Ring1][O][=N][Ring2][Ring1][#Branch2]
|
N16CC[C@H]2NC(=O)CC[C@@H]2C1.Cn1nnc7n1.C4(=O)[C@@H]68.c18cnc[nH]1.C57.N45
|
COCCOc1ccc(CC(=O)NC[C@H]2CCN2C(=O)C2=CCCCO2)cc1
|
COCCOccccCC=O)NC[C@H]CCN4C=O)C=CCCCO6)))))))))))))))cc6
|
[C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][C][C][O][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1]
|
C4(=O)C1=CCCCO1.c17ccc%10cc1.[C@H]19CCN14.C%10C3=O.C5C6.CO5.O67.N38.C89
|
CCCc1[nH]ccc1C(=O)N1CC[C@@H](NC(=O)c2cc(C)cc(F)c2)C[C@H]1C
|
CCCc[nH]ccc5C=O)NCC[C@@H]NC=O)cccC)ccF)c6))))))))C[C@H]6C
|
[C][C][C][C][NH1][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][C@H1][Ring1][P][C]
|
N13CC[C@@H]5C[C@H]1C.c17cc(C)cc(F)c1.c18[nH]ccc16.CCC8.C36=O.C47=O.N45
|
C=C(C)CC(=O)NC[C@]1(F)C[C@@H](CNC(=O)[C@H](CC(C)C)C(C)C)C1
|
C=CC)CC=O)NC[C@]F)C[C@@H]CNC=O)[C@H]CCC)C)))CC)C))))))C4
|
[C][=C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][C][C][Ring1][P]
|
C3(=O)[C@H](CC(C)C)C(C)C.C=C(C)CC2=O.[C@]16(F)C[C@H]7C1.N24.C46.C57.N35
|
COc1cc(NC(=O)C(=O)N2CCN(C(C)=O)CC2)nn1C
|
COcccNC=O)C=O)NCCNCC)=O))CC6)))))))))nn5C
|
[C][O][C][=C][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][=Branch2][=N][N][Ring2][Ring1][Ring1][C]
|
c16cc7nn1C.N14CCN5CC1.C3(=O)C4=O.C5(C)=O.CO6.N37
|
C[C@@H](NC(N)=O)C(=O)N[C@@H](Cn1cccn1)C(=O)NC1CC2(CCCCO2)C1
|
C[C@@H]NCN)=O)))C=O)N[C@@H]Cncccn5))))))C=O)NCCCCCCCO6)))))C4
|
[C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch2][C][C][C][C][O][Ring1][=Branch1][C][Ring1][=Branch2]
|
C18CC2(CCCCO2)C1.[C@H]7(C9)C5=O.C[C@@H]6C4=O.n19cccn1.C3(N)=O.N36.N47.N58
|
CC(C)CO[C@H](C)C(=O)N[C@@H]1CC[C@@H]2CN(C[C@@H]3CCC(F)(F)C3)C[C@@H]2C1
|
CCC)CO[C@H]C)C=O)N[C@@H]CC[C@@H]CNC[C@@H]CCCF)F)C5))))))C[C@@H]5C9
|
[C][C][Branch1][C][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][C][N][Branch1][#C][C][C@@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][C@@H1][Ring1][=N][C][Ring1][P]
|
[C@@H]18CC[C@@H]2CN7C[C@@H]2C1.[C@@H]19CCC(F)(F)C1.[C@@H]6(C)C4=O.CC(C)C5.O56.N48.C79
|
CC1(C)COC[C@H]1C(=O)NC1(CCNC(=O)CCCc2cccs2)CCC1
|
CCC)COC[C@H]5C=O)NCCCNC=O)CCCccccs5))))))))))))CCC4
|
[C][C][Branch1][C][C][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][=C][C][=C][S][Ring1][Branch1][C][C][C][Ring1][P]
|
CC1(C)COC[C@H]17.C4(=O)CCC8.C159CCC1.c18cccs1.C37=O.C9C6.N35.N46
|
COC(=O)c1nc[nH]c1NC(=O)[C@@]1(O)CCN(c2nc(C)nc3ccccc23)C1
|
COC=O)cnc[nH]c5NC=O)[C@@]O)CCNcncC)ncccccc%106))))))))))C5
|
[C][O][C][=Branch1][C][=O][C][N][=C][NH1][C][=Ring1][Branch1][N][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][N][Branch2][Ring1][C][C][=N][C][Branch1][C][C][=N][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1][C][Ring1][P]
|
c17nc(C)nc2ccccc12.[C@]19(O)CCN7C1.c18nc[nH]c16.C48=O.C59=O.CO4.N56
|
C=CC1(CC(=O)N2CC[C@@H]3CCN(C(=O)c4cc(F)c(C)cc4F)[C@@H]3C2)CCC1
|
C=CCCC=O)NCC[C@@H]CCNC=O)cccF)cC)cc6F))))))))[C@@H]5C9)))))))))))CCC4
|
[C][=C][C][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][C][C][=C][Ring1][Branch2][F][C@@H1][Ring1][S][C][Ring2][Ring1][Ring2][C][C][C][Ring2][Ring1][O]
|
N15CC[C@@H]2CCN6[C@@H]2C1.c17cc(F)c(C)cc1F.C=CC18CCC1.C8C5=O.C67=O
|
C[C@@H](O)[C@@H](NC(N)=O)C(=O)N1CCC(C2(NC(=O)CCc3cc[nH]n3)CC2)CC1
|
C[C@@H]O)[C@@H]NCN)=O)))C=O)NCCCCNC=O)CCccc[nH]n5)))))))))CC3)))CC6
|
[C][C@@H1][Branch1][C][O][C@@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][C][=C][NH1][N][=Ring1][Branch1][C][C][Ring1][=N][C][C][Ring2][Ring1][Ring1]
|
N15CCC(C28CC2)CC1.C[C@@H](O)[C@@H]7C5=O.C6(=O)CC9.c19cc[nH]n1.C4(N)=O.N47.N68
|
COc1nc(C(=O)N2C[C@H]3C[C@H](C)N(C(=O)[C@@H]4CC45CCOCC5)[C@H]3C2)sc1C
|
COcncC=O)NC[C@H]C[C@H]C)NC=O)[C@@H]CC3CCOCC6)))))))))[C@H]5C8)))))))))sc5C
|
[C][O][C][N][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][O][C][C][Ring1][=Branch1][C@H1][Ring1][S][C][Ring2][Ring1][Ring1][S][C][=Ring2][Ring1][#Branch2][C]
|
N16C[C@H]2C[C@H](C)N7[C@H]2C1.[C@@H]1%10CC12CCOCC2.c18nc9sc1C.C69=O.C7%10=O.CO8
|
CO[C@H](C(=O)NC[C@H]1[C@@H](C2CC2)CCN1C(=O)c1cc(F)cc(N)c1N)C(C)C
|
CO[C@H]C=O)NC[C@H][C@@H]CCC3)))CCN5C=O)cccF)ccN)c6N))))))))))))))))CC)C
|
[C][O][C@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@H1][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][N][=C][Ring1][Branch2][N][C][Branch1][C][C][C]
|
[C@H]18[C@@H](C2CC2)CCN14.c17cc(F)cc(N)c1N.[C@@H]5(C3=O)C(C)C.C47=O.CO5.N36.C68
|
COc1cncc(C(=O)N2C[C@H](C(=O)N3CC[C@@H]3[C@H](C)O)[C@@H](C(C)C)C2)c1
|
COccnccC=O)NC[C@H]C=O)NCC[C@@H]4[C@H]C)O)))))))[C@@H]CC)C))C5))))))c6
|
[C][O][C][=C][N][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C@H1][Branch1][C][C][O][C@@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring1][P][=C][Ring2][Ring1][=Branch2]
|
c16cncc8c1.N14C[C@H]7[C@@H]%10C1.N15CC[C@@H]19.C48=O.C57=O.[C@@H]9(C)O.C%10(C)C.CO6
|
C=C=CCC(=O)N[C@H](CCN(C)C)C(=O)Nc1cc(C)cn(C)c1=O
|
C=C=CCC=O)N[C@H]CCNC)C))))C=O)NcccC)cnC)c6=O
|
[C][=C][=C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][C][=C][N][Branch1][C][C][C][Ring1][Branch2][=O]
|
c16cc(C)cn(C)c1=O.[C@@H]4(CC5)C3=O.C=C=CCC2=O.N5(C)C.N24.N36
|
C[C@@H](CO)C(=O)NC[C@]1(CNc2cc(O)ncn2)CC12CCC2
|
C[C@@H]CO))C=O)NC[C@]CNcccO)ncn6))))))))CC3CCC4
|
[C][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C@][Branch1][=C][C][N][C][=C][C][Branch1][C][O][=N][C][=N][Ring1][#Branch1][C][C][Ring1][N][C][C][C][Ring1][Ring2]
|
[C@@]178CC12CCC2.c16cc(O)ncn1.C[C@@H](CO)C3=O.N34.C47.C58.N56
|
O=C1CC(c2ccc(NC(=O)CSc3ccc(Cl)cc3)cc2)CC(=O)N1
|
O=CCCccccNC=O)CSccccCl)cc6))))))))))cc6))))))CC=O)N6
|
[O][=C][C][C][Branch2][Ring1][#C][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][C][C][C][=Branch1][C][=O][N][Ring2][Ring1][=Branch2]
|
O=C1CC8CC(=O)N1.c18ccc6cc1.c17ccc(Cl)cc1.C4(=O)C5.N46.S57
|
CN(C[C@@H](O)CNC(=O)c1c(F)cccc1C1CC1)C(=O)c1ccc(Cl)cn1
|
CNC[C@@H]O)CNC=O)ccF)cccc6CCC3))))))))))))))C=O)ccccCl)cn6
|
[C][N][Branch2][Ring1][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1]
|
c17c8cccc1F.c16ccc(Cl)cn1.C4[C@@H](O)C5.CN34.C27=O.C18CC1.C36=O.N25
|
Cc1cscc1C(=O)NC[C@H]1CC[C@@H](C(=O)NC[C@H](C)n2cccn2)O1
|
Cccscc5C=O)NC[C@H]CC[C@@H]C=O)NC[C@H]C)ncccn5)))))))))O5
|
[C][C][=C][S][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][C][=C][C][=N][Ring1][Branch1][O][Ring1][S]
|
Cc1cscc18.[C@H]1%10CC[C@@H]7O1.n19cccn1.C6[C@@H]9C.C38=O.C47=O.N35.C5%10.N46
|
Cc1ncc(C(=O)N[C@]23CCCCC[C@@H]2N(C(=O)[C@H]2CCC[C@@H](F)C2)CC3)o1
|
CcnccC=O)N[C@]CCCCC[C@@H]7NC=O)[C@H]CCC[C@@H]F)C6)))))))CC%10))))))))))))o5
|
[C][C][=N][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@][C][C][C][C][C][C@@H1][Ring1][#Branch1][N][Branch1][S][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][C][F][C][Ring1][#Branch1][C][C][Ring2][Ring1][Ring1][O][Ring2][Ring1][O]
|
[C@]126CCCCC[C@@H]1N5CC2.[C@H]18CCC[C@@H](F)C1.Cc1ncc7o1.C47=O.C58=O.N46
|
CC(C)(C)C[C@@H](O)C(=O)N[C@H](CNC(=O)CC1(C#N)CCC1)C(C)(C)C
|
CCC)C)C[C@@H]O)C=O)N[C@H]CNC=O)CCC#N))CCC4))))))))CC)C)C
|
[C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][#N][C][C][C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C]
|
CC(C)(C)C[C@@H](O)C2=O.[C@@H]4(C5)C(C)(C)C.C16(C#N)CCC1.C3(=O)C6.N24.N35
|
CC[C@H](C)[C@H](C)C(=O)N(C)CCOCCCNC(=O)CN(C)C1CC1
|
CC[C@H]C)[C@H]C)C=O)NC)CCOCCCNC=O)CNC)CCC3
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][O][C][C][C][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][C][Ring1][Ring1]
|
CC[C@H](C)[C@H](C)C2=O.C5CC7.C3(=O)C8.N26C.C6C4.N89C.C19CC1.O45.N37
|
Cc1cnc(CN=c2cc(C)[nH]c(=NCc3ccccc3Br)[nH]2)[nH]1
|
CccncCN=cccC)[nH]c=NCcccccc6Br)))))))))[nH]6))))))))[nH]5
|
[C][C][=C][N][=C][Branch2][Ring1][O][C][N][=C][C][=C][Branch1][C][C][NH1][C][=Branch1][N][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][NH1][Ring1][S][NH1][Ring2][Ring1][#Branch1]
|
C4N=c1cc(C)[nH]c(=NC5)[nH]1.c15ccccc1Br.Cc1cnc4[nH]1
|
CON(C)C(=O)CCN1CCC(c2nc(C(F)(F)F)cs2)CC1
|
CONC)C=O)CCNCCCcncCF)F)F))cs5)))))CC6
|
[C][O][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][C][C][C][Branch2][Ring1][C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][S][Ring1][=Branch2][C][C][Ring1][#C]
|
CON(C)C(=O)CC3.N13CCC5CC1.c15nc4cs1.C4(F)(F)F
|
CC(=O)N1CCC[C@@H](c2n[nH]c(CNC(=O)c3ccc(CN4CCCC4)o3)n2)C1
|
CC=O)NCCC[C@@H]cn[nH]cCNC=O)ccccCNCCCC5))))))o5))))))))n5)))))C6
|
[C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring2][Ring1][C][=N][NH1][C][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][N][C][C][C][C][Ring1][Branch1][O][Ring1][O][=N][Ring2][Ring1][Ring2][C][Ring2][Ring1][#Branch2]
|
N15CCC[C@@H]%12C1.c1%12n[nH]c%10n1.c19ccc%11o1.N18CCCC1.CC5=O.C69=O.C7%10.N67.C8%11
|
C=CCCn1cc(C(=O)N2C[C@H]3C[C@H]2CC[C@H]3NC(=O)[C@@H](O)C=CCCC)nn1
|
C=CCCnccC=O)NC[C@H]C[C@H]5CC[C@H]6NC=O)[C@@H]O)C=CCCC)))))))))))))))))nn5
|
[C][=C][C][C][N][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][C][C][N][=N][Ring2][Ring1][=Branch2]
|
N14C[C@H]2C[C@H]1CC[C@H]26.n19cc7nn1.C5(=O)[C@@H](O)C=8.C=CCC9.C=8CCC.C47=O.N56
|
C[C@H]1CCCCCCN1S(=O)(=O)CCCS(=O)(=O)N(CC#N)C1CCCC1
|
C[C@H]CCCCCCN8S=O)=O)CCCS=O)=O)NCC#N)))CCCCC5
|
[C][C@H1][C][C][C][C][C][C][N][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][Ring2][C][C][#N][C][C][C][C][C][Ring1][Branch1]
|
S3(=O)(=O)CCCS4(=O)=O.C[C@H]1CCCCCCN13.C15CCCC1.N245.C2C#N
|
O=C(CN1CC[C@H](c2cc(F)cc(F)c2)C1)NC(=O)c1ccc(Cl)cc1
|
O=CCNCC[C@H]cccF)ccF)c6))))))C5))))))NC=O)ccccCl)cc6
|
[O][=C][Branch2][Ring1][=Branch2][C][N][C][C][C@H1][Branch1][#C][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][Ring1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
c17cc(F)cc(F)c1.c16ccc(Cl)cc1.N15CC[C@H]7C1.O=C3C5.C46=O.N34
|
C[C@H](C(=O)N1CC[C@H](N2CCC2)C1)n1cc(CCN2CCN(C)CC2)nn1
|
C[C@H]C=O)NCC[C@H]NCCC4))))C5))))))nccCCNCCNC)CC6))))))))nn5
|
[C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][#Branch1][N][C][C][C][Ring1][Ring2][C][Ring1][=Branch2][N][C][=C][Branch1][=C][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][N][=N][Ring1][=C]
|
N14CCN(C)CC1.N13CC[C@H]5C1.n16cc7nn1.C[C@@H]6C3=O.N15CCC1.C7C4
|
Cc1oc(Cl)nc1C(=O)NC[C@@H]1CCN(C(=O)[C@@]2(C)CC=CCC2)C[C@@H]1O
|
CcocCl)nc5C=O)NC[C@@H]CCNC=O)[C@@]C)CC=CCC6)))))))C[C@@H]6O
|
[C][C][O][C][Branch1][C][Cl][=N][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][=C][C][C][Ring1][#Branch1][C][C@@H1][Ring1][#C][O]
|
[C@@H]18CCN4C[C@@H]1O.Cc1oc(Cl)nc16.[C@]17(C)CC=CCC1.C36=O.C47=O.N35.C58
|
O=C1CC[C@@H]2[C@@H]1[C@@H]2C(=O)NC[C@H]1CCN(C(=O)c2cn(C3CC3)nn2)C[C@@H]1O
|
O=CCC[C@@H][C@@H]5[C@@H]3C=O)NC[C@H]CCNC=O)ccnCCC3)))nn5))))))C[C@@H]6O
|
[O][=C][C][C][C@@H1][C@@H1][Ring1][Branch1][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][=N][Ring1][Branch2][C][C@@H1][Ring1][S][O]
|
[C@H]19CCN5C[C@@H]1O.O=C1CC[C@H]2[C@@H]8[C@H]12.c17cn%10nn1.C48=O.C57=O.C1%10CC1.N46.C69
|
CCCCCCC(=O)N[C@]1(COC)CCN(C(=O)CCc2csnn2)C1
|
CCCCCCC=O)N[C@]COC)))CCNC=O)CCccsnn5))))))))C5
|
[C][C][C][C][C][C][C][=Branch1][C][=O][N][C@][Branch1][Ring2][C][O][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][=C][S][N][=N][Ring1][Branch1][C][Ring1][P]
|
CCCCCCC3=O.[C@@]168CCN4C1.C4(=O)CC7.c17csnn1.N36.C58.O5C
|
C[C@H](NC(=O)c1cc(Cl)c[nH]1)[C@@H](CO)NC(=O)c1occc1CN1CCOCC1
|
C[C@H]NC=O)cccCl)c[nH]5)))))))[C@@H]CO))NC=O)coccc5CNCCOCC6
|
[C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][NH1][Ring1][=Branch1][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][N][C][C][O][C][C][Ring1][=Branch1]
|
C[C@H]4[C@H]5CO.c17cc(Cl)c[nH]1.c18occc19.N16CCOCC1.C27=O.C38=O.N24.N35.C69
|
COc1ccccc1C(=O)NCCCCNC(=O)c1cc(N=S(C)(C)=O)ccn1
|
COcccccc6C=O)NCCCCNC=O)cccN=SC)C)=O)))ccn6
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch2][N][=S][Branch1][C][C][Branch1][C][C][=O][=C][C][=N][Ring1][O]
|
c17cc(N=S(C)(C)=O)ccn1.c14ccccc18.C5CCC6.C28=O.C37=O.CO4.N25.N36
|
C[C@@H](CN(C)C(=O)c1ccccc1F)C(=O)N1CC(n2cnnn2)C1
|
C[C@@H]CNC)C=O)cccccc6F))))))))))C=O)NCCncnnn5)))))C4
|
[C][C@@H1][Branch2][Ring1][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][Ring1][=Branch2]
|
c16ccccc1F.C[C@@H](C5)C4=O.N14CC7C1.n17cnnn1.N35C.C36=O
|
CCc1nonc1C(=O)N[C@]12CCC[C@@H]1N(C(=O)C[C@H]1CC1(C)C)CCC2
|
CCcnonc5C=O)N[C@]CCC[C@@H]5NC=O)C[C@H]CC3C)C))))))CCC9
|
[C][C][C][=N][O][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@][C][C][C][C@@H1][Ring1][Branch1][N][Branch1][#C][C][=Branch1][C][=O][C][C@H1][C][C][Ring1][Ring1][Branch1][C][C][C][C][C][C][Ring1][P]
|
[C@]125CCC[C@@H]1N4CCC2.c17nonc16.[C@H]18CC1(C)C.C4(=O)C8.C36=O.CC7.N35
|
CCO[C@H](C(=O)N1CC([C@H](C)NC(=O)[C@@H](SC)C(C)C)C1)C(C)C
|
CCO[C@H]C=O)NCC[C@H]C)NC=O)[C@@H]SC))CC)C))))))C4)))))CC)C
|
[C][C][O][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][S][C][C][Branch1][C][C][C][C][Ring1][#C][C][Branch1][C][C][C]
|
[C@@H]5(C2=O)C(C)C.C3(=O)[C@@H]7C(C)C.N12CC8C1.[C@@H]68C.CC4.O45.N36.S7C
|
C#CCC(CC#C)C(=O)N1CC[C@@H](CNC(=O)c2nc(-c3cccs3)oc2C)C1
|
C#CCCCC#C)))C=O)NCC[C@@H]CNC=O)cnc-ccccs5)))))oc5C)))))))))C5
|
[C][#C][C][C][Branch1][Ring2][C][C][#C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][N][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][O][C][=Ring1][#Branch2][C][C][Ring2][Ring1][Ring2]
|
C#CCC(CC#C)C4=O.c17nc9oc1C.N14CC[C@@H]8C1.c19cccs1.C57=O.C68.N56
|
CCCc1nc(C(=O)NC[C@@H]2CC[C@H](NC(=O)C=C3CCC3)C2)co1
|
CCCcncC=O)NC[C@@H]CC[C@H]NC=O)C=CCCC4)))))))C5))))))))co5
|
[C][C][C][C][=N][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Ring2][C][Ring1][=N][=C][O][Ring2][Ring1][=Branch1]
|
c1%10nc8co1.[C@@H]1%11CC[C@H]7C1.C5(=O)C=9.C1=9CCC1.CCC%10.C48=O.N46.C6%11.N57
|
O=C(NC[C@H](F)C1CCN(C(=O)C2(CO)CCC2)CC1)c1ccc([N+](=O)[O-])s1
|
O=CNC[C@H]F)CCCNC=O)CCO))CCC4)))))CC6)))))))))cccc[N+]=O)[O-]))s5
|
[O][=C][Branch2][Ring1][#C][N][C][C@H1][Branch1][C][F][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][C][Ring1][=Branch1][C][C][Ring1][=C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][S][Ring1][Branch2]
|
c16ccc([N+](=O)[O-])s1.C18CCN4CC1.C179CCC1.C5[C@@H]8F.O=C36.C47=O.N35.C9O
|
O=C(N[C@@H]1CC12CCN(Cc1ccc3cc[nH]c3c1)CC2)c1cc([N+](=O)[O-])cs1
|
O=CN[C@@H]CC3CCNCcccccc[nH]c5c9))))))))))CC6)))))))))ccc[N+]=O)[O-]))cs5
|
[O][=C][Branch2][Ring1][=C][N][C@@H1][C][C][Ring1][Ring1][C][C][N][Branch1][#C][C][C][=C][C][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C][Ring1][S][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][S][Ring1][Branch2]
|
[C@@H]16CC12CCN5CC2.c18ccc2cc[nH]c2c1.c17cc([N+](=O)[O-])cs1.O=C47.N46.C58
|
CCCC[C@H](C)C(=O)N1CCCC[C@H]1c1n[nH]cc1C(=O)NCC(C)C
|
CCCC[C@H]C)C=O)NCCCC[C@H]6cn[nH]cc5C=O)NCCC)C
|
[C][C][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C]
|
CCCC[C@H](C)C2=O.N12CCCC[C@H]16.c16n[nH]cc15.C4C(C)C.C35=O.N34
|
CCC[C@H]1CCN(C(=O)C2(N(C(=O)C[C@H]3C[C@H](SC)C3)C3CC3)CCC2)C1
|
CCC[C@H]CCNC=O)CNC=O)C[C@H]C[C@H]SC))C4))))))CCC3))))CCC4)))))C5
|
[C][C][C][C@H1][C][C][N][Branch2][Ring2][Branch1][C][=Branch1][C][=O][C][Branch2][Ring1][Branch2][N][Branch1][S][C][=Branch1][C][=O][C][C@H1][C][C@H1][Branch1][Ring1][S][C][C][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][P][C][Ring2][Ring1][Branch2]
|
[C@H]19CCN4C1.C168CCC1.[C@H]1%10C[C@H]%11C1.C5(=O)C%10.CCC9.C48=O.N567.C17CC1.S%11C
|
C[C@@H]1CC[C@@H](CNC(=O)c2nccnc2C(N)=O)N(C(=O)CC2CCCC2)C1
|
C[C@@H]CC[C@@H]CNC=O)cnccnc6CN)=O)))))))))))NC=O)CCCCCC5)))))))C6
|
[C][C@@H1][C][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=N][C][=C][N][=C][Ring1][=Branch1][C][Branch1][C][N][=O][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][O]
|
C[C@@H]1CC[C@@H]8N4C1.c16nccnc17.C19CCCC1.C4(=O)C9.C36=O.C7(N)=O.C58.N35
|
CC(C)(C)NS(=O)(=O)CC(=O)N1CC[C@H](OCCNC(=O)CCc2ccoc2)C1
|
CCC)C)NS=O)=O)CC=O)NCC[C@H]OCCNC=O)CCcccoc5))))))))))))C5
|
[C][C][Branch1][C][C][Branch1][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][C][O][C][C][N][C][=Branch1][C][=O][C][C][C][C][=C][O][C][=Ring1][Branch1][C][Ring2][Ring1][C]
|
S9(=O)(=O)CC3=O.N13CC[C@H]6C1.C4(=O)CC%10.c1%10ccoc1.CC7(C)C.C5C8.N79.O56.N48
|
CC[C@](C)(CNC(=O)C1(n2ccc(C3CC3)n2)CC1)NC(=O)C(OC)OC
|
CC[C@]C)CNC=O)CncccCCC3)))n5)))))CC3))))))NC=O)COC))OC
|
[C][C][C@][Branch1][C][C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][Branch1][#C][N][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][Branch2][C][C][Ring1][O][N][C][=Branch1][C][=O][C][Branch1][Ring1][O][C][O][C]
|
CC[C@]8(C)C9.n1%11ccc%12n1.C5(=O)C67.C1%10%11CC1.C4%10=O.C1%12CC1.N49.N58.O6C.O7C
|
CCc1cccc(CC)c1C(=O)N1CC[C@@](C)(NC(=O)C[C@H]2CCCS2(=O)=O)C1
|
CCcccccCC))c6C=O)NCC[C@@]C)NC=O)C[C@H]CCCS5=O)=O)))))))))C5
|
[C][C][C][=C][C][=C][C][Branch1][Ring1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O][C][Ring1][P]
|
c18cccc9c16.N13CC[C@]5(C)C1.[C@H]17CCCS1(=O)=O.C4(=O)C7.C36=O.CC8.C9C.N45
|
Cc1scnc1C(=O)N[C@@H]1CN(C(=O)c2cnnn2C)CC[C@@H]1C(F)(F)F
|
Ccscnc5C=O)N[C@@H]CNC=O)ccnnn5C)))))))CC[C@@H]6CF)F)F
|
[C][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][N][=N][N][Ring1][Branch1][C][C][C][C@@H1][Ring1][=C][C][Branch1][C][F][Branch1][C][F][F]
|
[C@@H]15CN4CC[C@@H]18.Cc1scnc16.c17cnnn1C.C8(F)(F)F.C36=O.C47=O.N35
|
CCC1CC(C(=O)N2CC[C@H](C(=O)Nc3cc(C)cc(O)c3)[C@H]2C)C1
|
CCCCCC=O)NCC[C@H]C=O)NcccC)ccO)c6))))))))[C@H]5C)))))))C4
|
[C][C][C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][C@H1][Ring1][S][C][C][Ring2][Ring1][#Branch1]
|
c16cc(C)cc(O)c1.N14CC[C@H]8[C@H]1C.C19CC7C1.C47=O.C58=O.CC9.N56
|
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