SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
CCOCCC(=O)N(C)C[C@]1(O)CCCN(C(=O)c2cncc3ncccc23)C1
|
CCOCCC=O)NC)C[C@]O)CCCNC=O)ccnccncccc%106)))))))))))C6
|
[C][C][O][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@][Branch1][C][O][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][C][=N][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][Ring2][Ring1][Ring1]
|
c19cncc2ncccc12.[C@@]1%10(O)CCCN5C1.C7CC4=O.N48C.C59=O.CC6.O67.C8%10
|
O=C(Nc1ccc(SC(F)(F)F)cc1)C(=O)N1CCOCC(F)(F)C1
|
O=CNccccSCF)F)F)))cc6)))))))C=O)NCCOCCF)F)C7
|
[O][=C][Branch2][Ring1][Branch1][N][C][=C][C][=C][Branch1][#Branch2][S][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][=Branch1][C][=O][N][C][C][O][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch2]
|
N13CCOCC(F)(F)C1.c14ccc5cc1.O=C2C3=O.S5C(F)(F)F.N24
|
Cc1coc(C(=O)NC[C@@H]2CN(C(=O)CCCS(C)(=O)=O)[C@H]3CCN2C3)c1
|
CccocC=O)NC[C@@H]CNC=O)CCCSC)=O)=O))))))[C@H]CCN7C5)))))))))))c5
|
[C][C][=C][O][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C@H1][C][C][N][Ring1][S][C][Ring1][Branch1][=C][Ring2][Ring1][#Branch2]
|
[C@@H]18CN5[C@H]2CCN1C2.C5(=O)CCCS(C)(=O)=O.Cc1coc7c1.C47=O.N46.C68
|
CN1CCC[C@@H](CCC(=O)NC2(C)CCN(C(=O)c3cccnc3O)CC2)C1
|
CNCCC[C@@H]CCC=O)NCC)CCNC=O)ccccnc6O))))))))CC6))))))))))C6
|
[C][N][C][C][C][C@@H1][Branch2][Ring2][C][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][C][Ring1][S][C][Ring2][Ring1][O]
|
C16(C)CCN5CC1.CN1CCC[C@@H]8C1.c17cccnc1O.C8CC4=O.C57=O.N46
|
Cc1nc(S)sc1CC(=O)N1CC[C@H](NC(=O)c2cscc2C#N)C[C@@H]1C
|
CcncS)sc5CC=O)NCC[C@H]NC=O)ccscc5C#N)))))))))C[C@@H]6C
|
[C][C][N][=C][Branch1][C][S][S][C][=Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][#N][C][C@@H1][Ring1][S][C]
|
N13CC[C@H]5C[C@@H]1C.Cc1nc(S)sc17.c16cscc1C#N.C7C3=O.C46=O.N45
|
CO[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2CF)C[C@@H]1NC(=O)c1cc(Cl)n(C)n1
|
CO[C@@H]CNC=O)[C@@H]C[C@@H]3CF))))))C[C@@H]5NC=O)cccCl)nC)n5
|
[C][O][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][F][C][C@@H1][Ring1][N][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][Cl][N][Branch1][C][C][N][=Ring1][#Branch1]
|
[C@@H]15CN3C[C@@H]16.c17cc(Cl)n(C)n1.[C@@H]18C[C@@H]19.C38=O.C47=O.CO5.C9F.N46
|
CC[C@H]1CN(C(=O)CN2CCCS2(=O)=O)CCN1C(=O)CCc1ccc(=N)[nH]c1
|
CC[C@H]CNC=O)CNCCCS5=O)=O))))))))CCN6C=O)CCcccc=N)[nH]c6
|
[C][C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][N][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O][C][C][N][Ring1][S][C][=Branch1][C][=O][C][C][C][C][=C][C][=Branch1][C][=N][NH1][C][=Ring1][#Branch1]
|
[C@H]16CN3CCN14.N15CCCS1(=O)=O.c17ccc(=N)[nH]c1.C4(=O)CC7.C3(=O)C5.CC6
|
CCS(=O)(=O)N[C@@H](C)C(=O)N1C[C@@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)C[C@H]1CO
|
CCS=O)=O)N[C@@H]C)C=O)NC[C@@H]NC=O)CCCCC)C)C))C4)C4))))))C[C@H]5CO
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][Branch1][Ring2][C][Ring1][Branch2][C][Ring1][=Branch2][C][C@H1][Ring1][P][C][O]
|
N14C[C@@H]8C[C@H]1%10.C129CC%11(C1)C2.CCS7(=O)=O.[C@H]6(C)C4=O.C%11(C)(C)C.C59=O.N67.N58.C%10O
|
CC(C)NC(=O)CCN1CCC[C@@H](C(=O)N2CCCN(C=O)CC2)C1
|
CCC)NC=O)CCNCCC[C@@H]C=O)NCCCNC=O))CC7))))))))C6
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][N][C][C][C][C@@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][Ring1][C][=O][C][C][Ring1][=Branch2][C][Ring1][P]
|
N14CCCN(C=O)CC1.N16CCC[C@@H]7C1.C3(=O)CC6.CC5C.C47=O.N35
|
Cc1nc(C)c(C(=O)N[C@@H]2CCN(C(=O)c3cn4c(n3)[C@@H](C)CCC4)C2(C)C)o1
|
CcncC)cC=O)N[C@@H]CCNC=O)ccncn5)[C@@H]C)CCC6)))))))))C5C)C))))))))o5
|
[C][C][=N][C][Branch1][C][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C@@H1][Branch1][C][C][C][C][C][Ring1][Branch2][C][Ring1][P][Branch1][C][C][C][O][Ring2][Ring1][N]
|
c19cn2c(n1)[C@@H](C)CCC2.[C@@H]17CCN6C1(C)C.Cc1nc(C)c8o1.C58=O.C69=O.N57
|
CCn1cnc(C(=O)N[C@H]2C[C@H](CNC(=O)C3=CCCSC3)C23CCC3)c1
|
CCncncC=O)N[C@H]C[C@H]CNC=O)C=CCCSC6)))))))))C4CCC4)))))))))c5
|
[C][C][N][C][=N][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][C][S][C][Ring1][=Branch1][C][Ring1][=C][C][C][C][Ring1][Ring2][=C][Ring2][Ring1][=Branch2]
|
[C@H]17C[C@H]%10C12CCC2.C5(=O)C1=CCCSC1.n19cnc8c1.C48=O.CC9.N47.C6%10.N56
|
COc1ccc(N(CCc2nn[nH]n2)C(=O)c2ccnc(C(F)(F)F)c2N)cc1
|
COccccNCCcnn[nH]n5)))))))C=O)cccncCF)F)F))c6N)))))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring2][Ring2][N][Branch1][#Branch2][C][C][C][N][=N][NH1][N][=Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][N][C][=C][Ring2][Ring1][O]
|
c17ccnc9c1N.c14ccc6cc1.c18nn[nH]n1.C9(F)(F)F.N356.C5C8.C37=O.CO4
|
CN(Cc1ccnc(Cl)c1)C[C@H]1CCCCN1C(=O)c1nccc2occc12
|
CNCcccncCl)c6)))))))C[C@H]CCCCN6C=O)cncccoccc95
|
[C][N][Branch1][=N][C][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=N][C][=C][C][O][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
c16nccc2occc12.c18ccnc(Cl)c1.[C@H]17CCCCN13.CN45.C36=O.C48.C57
|
CSCC1(CC(=O)N2C[C@@H](C)C[C@H](NC(=O)C(F)(F)c3ccccc3C)C2)CC1
|
CSCCCC=O)NC[C@@H]C)C[C@H]NC=O)CF)F)cccccc6C))))))))))C6))))))))CC3
|
[C][S][C][C][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][#Branch2]
|
N14C[C@@H]7C[C@H](C)C1.c1%10ccccc1C.C5(=O)C%10(F)F.C189CC1.C9C4=O.CS6.C68.N57
|
CN1CC[C@H](CN(C)C(=O)CCC2(C)CN(C(=O)[C@H]3CC34CCCCC4)C2)C1
|
CNCC[C@H]CNC)C=O)CCCC)CNC=O)[C@H]CC3CCCCC6)))))))))C4)))))))))C5
|
[C][N][C][C][C@H1][Branch2][Ring2][#Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][C][C][C][Ring1][=Branch1][C][Ring1][#C][C][Ring2][Ring1][O]
|
[C@H]18CC12CCCCC2.CN1CC[C@H]9C1.C1%10(C)CN6C1.C5(=O)CC%10.N57C.C68=O.C79
|
CCNC(=O)CCC(=O)NC(C)(C)CCCC(=O)NC[C@@H](O)CCOC
|
CCNC=O)CCC=O)NCC)C)CCCC=O)NC[C@@H]O)CCOC
|
[C][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C][O][C]
|
C6(C)(C)CCCC3=O.C1(=O)CCC2=O.C7[C@@H](O)CC4.CC5.N15.N26.N37.O4C
|
CC[C@@H](C(=O)N1CCCC[C@@]2(CCN(C(=O)C3=C[C@H]4C=C[C@H]3C4)C2)C1)C(F)(F)F
|
CC[C@@H]C=O)NCCCC[C@@]CCNC=O)C=C[C@H]C=C[C@H]6C5))))))))C5))))C7))))))))CF)F)F
|
[C][C][C@@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][C][C@@][Branch2][Ring1][Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C@H1][C][=C][C@H1][Ring1][=Branch1][C][Ring1][Branch1][C][Ring1][=C][C][Ring2][Ring1][Ring2][C][Branch1][C][F][Branch1][C][F][F]
|
N15CCCC[C@@]2(CCN6C2)C1.CC[C@@H](C5=O)C(F)(F)F.C6(=O)C1=C[C@H]2C=C[C@H]1C2
|
CS(=O)(=O)c1ccc(C(=O)N2CC(CO)(NC(=O)[C@@H]3CCCn4cnnc43)C2)[nH]1
|
CS=O)=O)ccccC=O)NCCCO))NC=O)[C@@H]CCCncnnc59)))))))))))C4)))))[nH]5
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][O][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][C][=N][N][=C][Ring1][Branch1][Ring1][=Branch2][C][Ring2][Ring1][C][NH1][Ring2][Ring1][=Branch2]
|
C6(=O)[C@@H]1CCCn2cnnc21.CS(=O)(=O)c1ccc8[nH]1.N15CC79C1.C58=O.C9O.N67
|
CC(C)N(C)CCCNC(=O)[C@H](CC(F)F)N(C)C(=O)C1=CC(C)(C)C1
|
CCC)NC)CCCNC=O)[C@H]CCF)F)))NC)C=O)C=CCC)C)C4
|
[C][C][Branch1][C][C][N][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1]
|
C2(=O)[C@@H]7CC(F)F.C3(=O)C1=CC(C)(C)C1.C5CC6.CC4C.N45C.N37C.N26
|
CC(=O)N1CCC[C@@H](NC(=O)CCN(CC2CC2)C(=O)[C@H](C)[C@@H](O)C(C)C)C1
|
CC=O)NCCC[C@@H]NC=O)CCNCCCC3))))C=O)[C@H]C)[C@@H]O)CC)C))))))))))C6
|
[C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring2][C][N][C][=Branch1][C][=O][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C][Branch1][C][C][C][C][Ring2][Ring1][=Branch2]
|
C5(=O)[C@H](C)[C@@H](O)C(C)C.N13CCC[C@@H]8C1.C4(=O)CC6.CC3=O.N567.C19CC1.N48.C79
|
Cn1cc(C(=O)NC2CC3(C2)CC(C(=O)NCCCC2CCCC2)C3)ncc1=O
|
CnccC=O)NCCCC4)CCC=O)NCCCCCCCC5))))))))))C4))))))))ncc6=O
|
[C][N][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch1][S][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][Ring1][Branch1][C][Ring1][S][N][=C][C][Ring2][Ring1][O][=O]
|
Cn1cc8ncc1=O.C17CC2(C1)CC9C2.C1%10CCCC1.C6CC%10.C48=O.C59=O.N47.N56
|
CC1(C)CC[C@@](NC(=O)[C@H]2C=CCC2)(C(=O)N2CC(CC(N)=O)C2)C1
|
CCC)CC[C@@]NC=O)[C@H]C=CCC5)))))))C=O)NCCCCN)=O)))C4)))))C5
|
[C][C][Branch1][C][C][C][C][C@@][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][=C][C][C][Ring1][Branch1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][Ring1][Branch2][C][Ring2][Ring1][Branch2]
|
CC1(C)CC[C@@]57C1.[C@H]16C=CCC1.N14CC8C1.C8C(N)=O.C36=O.C47=O.N35
|
CCc1nc(C)c(CC(=O)N[C@@H]2CC[C@H]2NC(=O)Cc2ccon2)c(C)n1
|
CCcncC)cCC=O)N[C@@H]CC[C@H]4NC=O)Ccccon5)))))))))))))))cC)n6
|
[C][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][=C][O][N][=Ring1][Branch1][C][Branch1][C][C][=N][Ring2][Ring1][=Branch2]
|
c17nc(C)c9c(C)n1.[C@@H]15CC[C@H]16.c18ccon1.C9C3=O.C4(=O)C8.CC7.N35.N46
|
C#CCn1cnnc1C(=O)NCC1(C(=O)NC[C@H](O)COCC)CC2(CC2)C1
|
C#CCncnnc5C=O)NCCC=O)NC[C@H]O)COCC))))))))CCCC3))C4
|
[C][#C][C][N][C][=N][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][O][C][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][S]
|
C1%114CC2(CC2)C1.n1%12cnnc1%10.C9[C@H](O)C6.C#CC%12.C3%10=O.C5%11=O.N38.C84.N59.O67.C7C
|
COC(OC)C(=O)N[C@H]1CC[C@@]2(CC1)CN(C(=O)CN1CC[C@@](C)(O)C1)CCO2
|
COCOC))C=O)N[C@H]CC[C@@]CC6))CNC=O)CNCC[C@@]C)O)C5)))))))CCO6
|
[C][O][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@H1][C][C][C@@][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][N][C][C][C@@][Branch1][C][C][Branch1][C][O][C][Ring1][#Branch1][C][C][O][Ring2][Ring1][C]
|
[C@H]18CC[C@@]2(CC1)CN4CCO2.N17CC[C@@](C)(O)C1.C56C3=O.C4(=O)C7.CO5.O6C.N38
|
CC(C)(C)C(=O)NCCC(=O)N[C@H]1CCCN(Cc2ccc3c(c2)CCC3)C1
|
CCC)C)C=O)NCCC=O)N[C@H]CCCNCcccccc6)CCC5)))))))))C6
|
[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C][N][Branch1][P][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][C][Ring1][S]
|
c19ccc2c(c1)CCC2.[C@H]18CCCN7C1.CC(C)(C)C4=O.C6CC5=O.N46.N58.C79
|
C[C@H]1CN(C(=O)C=CC2CCC2)CC[C@@H]1N(C)C(=O)CN1CCC(C(N)=O)CC1
|
C[C@H]CNC=O)C=CCCCC4)))))))CC[C@@H]6NC)C=O)CNCCCCN)=O))CC6
|
[C][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][C][C][C][Ring1][Ring2][C][C][C@@H1][Ring1][=C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2]
|
C[C@H]1CN3CC[C@@H]16.N15CCC7CC1.C=8C1CCC1.C3(=O)C=8.C4(=O)C5.N46C.C7(N)=O
|
CC(=O)NCCC(=O)NC[C@H]1CN(C(=O)[C@]2(C)CCCCNC2=O)CCC1(F)F
|
CC=O)NCCC=O)NC[C@H]CNC=O)[C@]C)CCCCNC7=O)))))))))CCC6F)F
|
[C][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][C][N][C][Ring1][Branch2][=O][C][C][C][Ring1][P][Branch1][C][F][F]
|
[C@H]19CN5CCC1(F)F.[C@@]18(C)CCCCNC1=O.C6CC4=O.CC3=O.C58=O.N36.N47.C79
|
C=CCOCCCC(=O)N(C)C[C@H](C)NC(=O)c1cccc2occc12
|
C=CCOCCCC=O)NC)C[C@H]C)NC=O)cccccoccc95
|
[C][=C][C][O][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][O][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
c19cccc2occc12.C6CCC3=O.C7[C@@H]8C.C=CC5.N37C.C49=O.O56.N48
|
CCCNC(=O)NC(C)(C)C(=O)NCC[C@]1(O)CCN(C(=O)C[C@H](C)C2CC2)C1
|
CCCNC=O)NCC)C)C=O)NCC[C@]O)CCNC=O)C[C@H]C)CCC3))))))C5
|
[C][C][C][N][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring1][=C]
|
[C@@]1%10(O)CCN6C1.C8(C)(C)C5=O.C6(=O)C[C@@H]%11C.CCC7.C34=O.C9C%10.C1%11CC1.N37.N48.N59
|
CC1=CC[C@@H](C(=O)N[C@@H](CO)CNC(=O)c2ccc(C)nc2C)CC1
|
CC=CC[C@@H]C=O)N[C@@H]CO))CNC=O)ccccC)nc6C)))))))))))))CC6
|
[C][C][=C][C][C@@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C][C][C][Ring2][Ring1][Branch2]
|
c18ccc(C)nc1C.CC1=CC[C@@H]7CC1.[C@@H]5(C6)CO.C37=O.C48=O.N35.N46
|
CC(C)S(=O)(=O)CC(=O)N1CC[C@@H](C)[C@@H](N(C)C(=O)[C@@H](O)Cc2ccccn2)C1
|
CCC)S=O)=O)CC=O)NCC[C@@H]C)[C@@H]NC)C=O)[C@@H]O)Ccccccn6))))))))))C6
|
[C][C][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C@@H1][Branch2][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring2][Ring1][Ring2]
|
CC(C)S(=O)(=O)CC3=O.N13CC[C@@H](C)[C@@H]5C1.C4(=O)[C@@H](O)C6.c16ccccn1.N45C
|
Cc1c(F)cccc1C(=O)N1CCC(F)(C(=O)N(C)Cc2nccs2)CC1
|
CccF)cccc6C=O)NCCCF)C=O)NC)Ccnccs5))))))))CC6
|
[C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][P][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=N][C][=C][S][Ring1][Branch1][C][C][Ring1][P]
|
Cc1c7cccc1F.N13CCC6(F)CC1.c18nccs1.C37=O.C46=O.N45C.C58
|
Cn1nnnc1[C@@](C)(NCc1nnc2ccc(Cl)cn12)[C@H]1CCCCO1
|
Cnnnnc5[C@@]C)NCcnnccccCl)cn96)))))))))))[C@H]CCCCO6
|
[C][N][N][=N][N][=C][Ring1][Branch1][C@@][Branch1][C][C][Branch2][Ring1][Ring1][N][C][C][=N][N][=C][C][=C][C][Branch1][C][Cl][=C][N][Ring1][#Branch2][Ring1][#Branch1][C@H1][C][C][C][C][O][Ring1][=Branch1]
|
c17nnc2ccc(Cl)cn12.Cn1nnnc16.[C@H]15CCCCO1.[C@@]356C.N34.C47
|
C[C@H]1CC[C@@H](C(=O)N[C@H]2CCCCC[C@H]2C(=O)N2CCC(C3CC3)CC2)O1
|
C[C@H]CC[C@@H]C=O)N[C@H]CCCCC[C@H]7C=O)NCCCCCC3)))CC6))))))))))))))))O5
|
[C][C@H1][C][C][C@@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][Ring1][=Branch2][O][Ring2][Ring1][#Branch2]
|
N15CCC(C2CC2)CC1.[C@H]16CCCCC[C@H]18.C[C@H]1CC[C@@H]7O1.C47=O.C58=O.N46
|
CC[C@H](C)CONC(=O)[C@H]1CCN(C(=O)[C@H]2CCC[C@@H]2C(C)C)C[C@H]1O
|
CC[C@H]C)CONC=O)[C@H]CCNC=O)[C@H]CCC[C@@H]5CC)C))))))))C[C@H]6O
|
[C][C][C@H1][Branch1][C][C][C][O][N][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Ring1][Branch1][C][Branch1][C][C][C][C][C@H1][Ring1][S][O]
|
[C@H]15CCN3C[C@H]1O.[C@H]16CCC[C@@H]17.CC[C@H](C)C4.O4NC5=O.C36=O.C7(C)C
|
CNC(=O)CCNC(=O)[C@H]1CC2(CO1)CC(F)(F)C2
|
CNC=O)CCNC=O)[C@H]CCCO5))CCF)F)C4
|
[C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C@H1][C][C][Branch1][Branch1][C][O][Ring1][Branch1][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2]
|
[C@H]16CC2(CO1)CC(F)(F)C2.C3(=O)CC5.C46=O.CN3.N45
|
CC(C)C(F)(F)CNC(=O)[C@H](Cc1cnn(C)c1O)NC(=O)[C@@H]1CNC(=O)N1
|
CCC)CF)F)CNC=O)[C@H]CccnnC)c5O)))))))NC=O)[C@@H]CNC=O)N5
|
[C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][O][N][C][=Branch1][C][=O][C@@H1][C][N][C][=Branch1][C][=O][N][Ring1][=Branch1]
|
CC(C)C(F)(F)C4.c17cnn(C)c1O.C2(=O)[C@@H]5C7.[C@@H]16CNC(=O)N1.C36=O.N24.N35
|
CC(C)(/C=C/C(=O)NC[C@@H]1COCCO1)NC(=O)[C@H](O)CC(F)(F)F
|
CCC)/C=C/C=O)NC[C@@H]COCCO6)))))))))))NC=O)[C@H]O)CCF)F)F
|
[C][C][Branch1][C][C][Branch1][P][/C][=C][/C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C][O][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)[C@H](O)CC(F)(F)F.[C@@H]17COCCO1.CC4(C)C=6.C=6C2=O.N25.C57.N34
|
O=C(CN1CCOCC1=O)N[C@H]1C[C@]2(C(=O)NCCn3ncnn3)CO[C@H]1C2
|
O=CCNCCOCC6=O))))))))N[C@H]C[C@]C=O)NCCnncnn5)))))))))CO[C@H]6C5
|
[O][=C][Branch1][O][C][N][C][C][O][C][C][Ring1][=Branch1][=O][N][C@H1][C][C@][Branch1][#C][C][=Branch1][C][=O][N][C][C][N][N][=C][N][=N][Ring1][Branch1][C][O][C@H1][Ring1][S][C][Ring1][#C]
|
[C@H]17C[C@]28CO[C@H]1C2.N1%10CCOCC1=O.n19ncnn1.O=C4C%10.C58=O.C6C9.N47.N56
|
O=C(N[C@@H]1CCN(C(=O)c2ccc(F)c(Cl)c2)C[C@H]1F)c1ccncc1Cl
|
O=CN[C@@H]CCNC=O)ccccF)cCl)c6)))))))C[C@H]6F))))))))cccncc6Cl
|
[O][=C][Branch2][Ring1][S][N][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][C][C@H1][Ring1][S][F][C][=C][C][=N][C][=C][Ring1][=Branch1][Cl]
|
[C@@H]15CCN4C[C@H]1F.c17ccc(F)c(Cl)c1.c16ccncc1Cl.O=C36.C47=O.N35
|
CC(C)(C)OC(=O)[C@@H]1CC2(CC2)CN1C(=O)Nc1cc2c(cc1Br)CCNC2=O
|
CCC)C)OC=O)[C@@H]CCCC3))CN5C=O)Ncccccc6Br)))CCNC6=O
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C@@H1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][N][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][Br][C][C][N][C][Ring1][=Branch2][=O]
|
c17cc2c(cc1Br)CCNC2=O.[C@@H]18CC2(CC2)CN14.CC6(C)C.C38=O.C45=O.O36.N57
|
CCc1[nH]nc(C(=O)N2C[C@H]3C[C@@H](NC(=O)c4ncnc(C)c4C)C[C@@H]2C3)c1Cl
|
CCc[nH]ncC=O)NC[C@H]C[C@@H]NC=O)cncncC)c6C)))))))))C[C@@H]7C6)))))))))c5Cl
|
[C][C][C][NH1][N][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=N][C][=N][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][C@@H1][Ring2][Ring1][C][C][Ring1][P][C][=Ring2][Ring1][#Branch2][Cl]
|
N15C[C@H]2C[C@@H]7C[C@@H]1C2.c19ncnc(C)c1C.c1%10[nH]nc8c1Cl.C58=O.C69=O.CC%10.N67
|
C=C(Br)CC(=O)NC1CCC(N(C)C(=O)C[C@H]2C=CS(=O)(=O)C2)CC1
|
C=CBr)CC=O)NCCCCNC)C=O)C[C@H]C=CS=O)=O)C5))))))))CC6
|
[C][=C][Branch1][C][Br][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][#Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C@H1][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1][C][C][Ring2][Ring1][C]
|
C15CCC6CC1.[C@H]17C=CS(=O)(=O)C1.C=C(Br)CC3=O.C4(=O)C7.N46C.N35
|
Cc1cc(C(=O)N2C[C@H]3C[C@H](NC(=O)[C@H]4CCS4(=O)=O)C[C@H]2C3)sc1C
|
CcccC=O)NC[C@H]C[C@H]NC=O)[C@H]CCS4=O)=O)))))))C[C@H]7C6)))))))))sc5C
|
[C][C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@H1][C][C][S][Ring1][Ring2][=Branch1][C][=O][=O][C][C@H1][Ring1][S][C][Ring1][#C][S][C][=Ring2][Ring1][Branch2][C]
|
N15C[C@H]2C[C@H]7C[C@H]1C2.Cc1cc9sc1C.[C@H]18CCS1(=O)=O.C59=O.C68=O.N67
|
O=C(N[C@H]1C[C@@H](CO)N(C(=O)c2cc(F)c(F)cc2F)C1)c1cnccn1
|
O=CN[C@H]C[C@@H]CO))NC=O)cccF)cF)cc6F))))))))C5))))))ccnccn6
|
[O][=C][Branch2][Ring2][Ring2][N][C@H1][C][C@@H1][Branch1][Ring1][C][O][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][=C][Ring1][Branch2][F][C][Ring2][Ring1][C][C][=C][N][=C][C][=N][Ring1][=Branch1]
|
c17cc(F)c(F)cc1F.[C@H]15C[C@@H]8N4C1.c16cnccn1.O=C36.C47=O.N35.C8O
|
O=C(Nc1cnn(-c2ccccn2)c1)[C@H]1C[C@H](F)CN(C(=O)Cc2cscn2)C1
|
O=CNccnn-cccccn6))))))c5))))))[C@H]C[C@H]F)CNC=O)Cccscn5)))))))C6
|
[O][=C][Branch2][Ring1][Ring1][N][C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=Ring1][O][C@H1][C][C@H1][Branch1][C][F][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][C][=N][Ring1][Branch1][C][Ring1][#C]
|
[C@H]16C[C@H](F)CN4C1.c15cnn8c1.c18ccccn1.c17cscn1.C4(=O)C7.O=C36.N35
|
O=S(=O)(NCC(F)(F)F)N1CC(N(Cc2ccccc2)Cc2ccccc2)C1
|
O=S=O)NCCF)F)F))))NCCNCcccccc6)))))))Ccccccc6))))))))C4
|
[O][=S][=Branch1][C][=O][Branch1][O][N][C][C][Branch1][C][F][Branch1][C][F][F][N][C][C][Branch2][Ring1][=Branch1][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring1]
|
O=S(=O)(N3)N1CC6C1.c17ccccc1.c18ccccc1.C3C(F)(F)F.N456.C47.C58
|
NC(=O)[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc([N+](=O)[O-])c(Cl)cc1F
|
NC=O)[C@@H]C[C@@H]cccccc6))))))CN5C=O)ccc[N+]=O)[O-]))cCl)cc6F
|
[N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][O][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Branch1][C][Cl][C][=C][Ring1][#Branch2][F]
|
c15cc([N+](=O)[O-])c(Cl)cc1F.[C@@H]14C[C@@H]6CN13.c16ccccc1.NC4=O.C35=O
|
CCC[C@@H](CNc1cc(N[C@@H]2CCN(c3cccc(C)c3)C2)nc(C)n1)OC
|
CCC[C@@H]CNcccN[C@@H]CCNcccccC)c6))))))C5))))))ncC)n6))))))))OC
|
[C][C][C][C@@H1][Branch2][Ring2][#Branch1][C][N][C][=C][C][Branch2][Ring1][=Branch1][N][C@@H1][C][C][N][Branch1][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Ring1][N][=N][C][Branch1][C][C][=N][Ring2][Ring1][Ring2][O][C]
|
c16cc7nc(C)n1.c18cccc(C)c1.CCC[C@H]4C5.[C@@H]19CCN8C1.N56.N79.O4C
|
Cc1ccnc([C@@H](C)NC(=O)[C@]2(F)CCN(C(=O)Cc3cccc(F)c3)C2)n1
|
Ccccnc[C@@H]C)NC=O)[C@]F)CCNC=O)CcccccF)c6))))))))C5))))))))n6
|
[C][C][=C][C][=N][C][Branch2][Ring2][=Branch1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][F][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring1][S][=N][Ring2][Ring1][O]
|
Cc1ccnc8n1.[C@@]17(F)CCN5C1.c19cccc(F)c1.C5(=O)C9.[C@H]68C.C47=O.N46
|
CC(C)Cc1nccc(C(=O)N2C[C@H]3CC[C@@H](C2)N(C(=O)Cc2cc[nH]c2)C3)n1
|
CCC)CcncccC=O)NC[C@H]CC[C@@H]C7)NC=O)Cccc[nH]c5)))))))C6)))))))))n6
|
[C][C][Branch1][C][C][C][C][=N][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][NH1][C][=Ring1][Branch1][C][Ring1][#C][=N][Ring2][Ring1][=Branch2]
|
N14C[C@H]2CC[C@@H](C1)N5C2.c17nccc6n1.c18cc[nH]c1.CC(C)C7.C5(=O)C8.C46=O
|
CO[C@@H](C)CC(=O)N[C@@H](C(=O)N1CC[Si](C)(C)CC1)c1ccnn1C
|
CO[C@@H]C)CC=O)N[C@@H]C=O)NCC[Si]C)C)CC6)))))))cccnn5C
|
[C][O][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Si][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2][C][=C][C][=N][N][Ring1][Branch1][C]
|
N13CC[Si](C)(C)CC1.[C@H]4(C)CC2=O.c16ccnn1C.[C@@H]56C3=O.CO4.N25
|
C[C@@H]1CCN(C(=O)c2c[nH]c3nccc-3c2)[C@H](C(=O)N[C@H](C)c2cnn(C)c2)C1
|
C[C@@H]CCNC=O)cc[nH]cnccc-5c9))))))))))[C@H]C=O)N[C@H]C)ccnnC)c5))))))))C6
|
[C][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][NH1][C][=N][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring2][Ring1][N]
|
c18c[nH]c2nccc-2c1.C[C@@H]1CCN4[C@H]7C1.c19cnn(C)c1.C48=O.C57=O.[C@H]69C.N56
|
Cc1nccn1[C@H](C)C(=O)N1CC2(CN(C(=O)c3cccn(C)c3=O)C2)C1
|
Ccnccn5[C@H]C)C=O)NCCCNC=O)ccccnC)c6=O))))))))C4)))C4
|
[C][C][=N][C][=C][N][Ring1][Branch1][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][N][Branch1][C][C][C][Ring1][#Branch1][=O][C][Ring1][=C][C][Ring1][P]
|
N14CC2(C1)CN5C2.c16cccn(C)c1=O.Cc1nccn17.[C@@H]7(C)C4=O.C56=O
|
CC=CC(=O)N[C@]1(C2CC2)CCN(C(=O)c2cnc3n2C[C@@H](C(F)(F)F)CC3)C1
|
CC=CC=O)N[C@]CCC3)))CCNC=O)ccncn5C[C@@H]CF)F)F))CC6))))))))))C5
|
[C][C][=C][C][=Branch1][C][=O][N][C@][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][C@@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#Branch2][C][Ring2][Ring1][#Branch1]
|
c17cnc2n1C[C@@H]9CC2.[C@@]16(C2CC2)CCN5C1.C=8C4=O.C9(F)(F)F.C57=O.CC=8.N46
|
CCC(=CC(=O)N1CC[C@@H]2CN(C(=O)C3(c4cccc(F)c4F)CC3)C[C@@H]21)CC
|
CCC=CC=O)NCC[C@@H]CNC=O)CcccccF)c6F)))))))CC3))))C[C@@H]58))))))))))CC
|
[C][C][C][=Branch2][Ring2][=C][=C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][Branch1][=N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F][C][C][Ring1][O][C][C@@H1][Ring2][Ring1][C][Ring2][Ring1][Branch1][C][C]
|
N15CC[C@@H]2CN6C[C@@H]21.c19cccc(F)c1F.CCC=8CC.C=8C5=O.C179CC1.C67=O
|
CC(C)(C(=O)NCCNC(=O)c1nnn(Cc2ccccc2)c1N)n1cccn1
|
CCC)C=O)NCCNC=O)cnnnCcccccc6)))))))c5N))))))))))))ncccn5
|
[C][C][Branch1][C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][N][=N][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][N][N][N][C][=C][C][=N][Ring1][Branch1]
|
c17nnn9c1N.CC8(C)C3=O.c1%10ccccc1.n18cccn1.C5C6.C47=O.N35.N46.C9%10
|
O=C(NC[C@H]1CCCN(C(=O)c2cc(Br)c[nH]2)C1)c1ccccc1-n1ccnn1
|
O=CNC[C@H]CCCNC=O)cccBr)c[nH]5))))))C6))))))))cccccc6-nccnn5
|
[O][=C][Branch2][Ring1][O][N][C][C@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][NH1][Ring1][=Branch1][C][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][N][=N][Ring1][Branch1]
|
[C@H]18CCCN4C1.c17ccccc19.c16cc(Br)c[nH]1.n19ccnn1.O=C37.C46=O.N35.C58
|
CSSCC(=O)N[C@@]12CCC[C@H]1N(C(=O)CC1CC1)CCC2
|
CSSCC=O)N[C@@]CCC[C@H]5NC=O)CCCC3)))))CCC9
|
[C][S][S][C][C][=Branch1][C][=O][N][C@@][C][C][C][C@H1][Ring1][Branch1][N][Branch1][O][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring1][C][C][C][Ring1][#C]
|
[C@@]126CCC[C@H]1N4CCC2.C5C3=O.C4(=O)C7.CSS5.C17CC1.N36
|
C=CCC1(C(=O)NC[C@]2(C)CCCN(C(=O)c3ncnc4c3CCCC4)C2)CC1
|
C=CCCC=O)NC[C@]C)CCCNC=O)cncncc6CCCC6)))))))))))C6)))))))))CC3
|
[C][=C][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=N][C][=N][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][#Branch2]
|
c18ncnc2c1CCCC2.[C@@]1%11(C)CCCN6C1.C19%10CC1.C=CC%10.C59=O.C68=O.N57.C7%11
|
CCOC(=O)c1cnc2nc(COC(=O)c3c(C)nn(C(C)(C)C)c3C)nn2c1
|
CCOC=O)ccncncCOC=O)ccC)nnCC)C)C))c5C)))))))))nn5c9
|
[C][C][O][C][=Branch1][C][=O][C][C][=N][C][=N][C][Branch2][Ring1][N][C][O][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][#Branch2][C][=N][N][Ring2][Ring1][Ring2][C][=Ring2][Ring1][Branch2]
|
c18cnc2nc%11nn2c1.c19c(C)nn%10c1C.C%10(C)(C)C.C48=O.C59=O.CC6.O46.C7%11.O57
|
CCCN1CCC[C@H]1C(=O)NC[C@H]1CCCN(C(=O)COC[C@@H]2CCCO2)C1
|
CCCNCCC[C@H]5C=O)NC[C@H]CCCNC=O)COC[C@@H]CCCO5)))))))))C6
|
[C][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][C@@H1][C][C][C][O][Ring1][Branch1][C][Ring1][S]
|
[C@H]1%11CCCN4C1.N17CCC[C@H]19.[C@@H]1%10CCCO1.C4(=O)C5.CCC7.C39=O.N38.C8%11.O56.C6%10
|
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N[C@H](C)C(C)(C)NC(=O)c1cccc(F)c1
|
C[C@@H]OccccF)cF)c6)))))))C=O)N[C@H]C)CC)C)NC=O)cccccF)c6
|
[C][C@@H1][Branch1][S][O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
c15ccc(F)c(F)c1.c18cccc(F)c1.[C@@H]6(C)C7(C)C.C[C@@H]4C2=O.C38=O.O45.N26.N37
|
N#Cc1cccc(CNC(=O)NCc2nc3ccccn3c2Br)n1
|
N#CcccccCNC=O)NCcncccccn6c9Br)))))))))))))))n6
|
[N][#C][C][=C][C][=C][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][N][C][C][N][=C][C][=C][C][=C][N][Ring1][=Branch1][C][=Ring1][=Branch2][Br][=N][Ring2][Ring1][=Branch1]
|
c19nc2ccccn2c1Br.N#Cc1cccc8n1.C45=O.C68.N46.N57.C79
|
CC[C@H](C)ONC(=O)[C@H]1CCCN(C(=O)c2ccc(C(C)=O)[nH]2)[C@H]1C
|
CC[C@H]C)ONC=O)[C@H]CCCNC=O)ccccCC)=O))[nH]5))))))[C@H]6C
|
[C][C][C@H1][Branch1][C][C][O][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][NH1][Ring1][Branch2][C@H1][Ring1][S][C]
|
[C@H]17CCCN3[C@H]1C.c15ccc6[nH]1.O4NC7=O.CC[C@@H]4C.C35=O.C6(C)=O
|
CC1(CC(=O)N2CC[C@@H](OCC(=O)NC[C@@H]3CCC(=O)N3)C2)CC1
|
CCCC=O)NCC[C@@H]OCC=O)NC[C@@H]CCC=O)N5))))))))))C5)))))))CC3
|
[C][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][O][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][Ring1][P][C][C][Ring2][Ring1][#Branch1]
|
N14CC[C@@H]7C1.[C@@H]19CCC(=O)N1.CC1%10CC1.C%10C4=O.C6C5=O.O67.N58.C89
|
CC1=C(C)C[C@H](C(=O)NC[C@@H](O)CNC(=O)Cc2c[nH]c3ccc(Cl)cc23)CC1
|
CC=CC)C[C@H]C=O)NC[C@@H]O)CNC=O)Ccc[nH]ccccCl)cc96)))))))))))))))))CC6
|
[C][C][=C][Branch1][C][C][C][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][C][Ring2][Ring1][N]
|
c19c[nH]c2ccc(Cl)cc12.CC1=C(C)C[C@H]8CC1.C6[C@@H](O)C7.C5(=O)C9.C48=O.N46.N57
|
Cc1nc(C)c(C(=O)N[C@H]2C[C@@H](CNC(=O)[C@H]3CC[C@H]4CCCCN43)C2)nc1C
|
CcncC)cC=O)N[C@H]C[C@@H]CNC=O)[C@H]CC[C@H]CCCCN69))))))))))))C4))))))nc6C
|
[C][C][=N][C][Branch1][C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@H1][C][C][C@H1][C][C][C][C][N][Ring1][=Branch1][Ring1][=Branch2][C][Ring1][P][N][=C][Ring2][Ring1][O][C]
|
Cc1nc(C)c%10nc1C.[C@H]19CC[C@H]2CCCCN21.[C@H]18C[C@@H]%11C1.C5%10=O.C69=O.N58.C7%11.N67
|
Cn1nc(C2CC2)cc1[C@@H](NC[C@@H]1CC2CCC1CC2)c1nnnn1CCCF
|
CnncCCC3)))cc5[C@@H]NC[C@@H]CCCCC6CC6))))))))))cnnnn5CCCF
|
[C][N][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring1][Branch2][C@@H1][Branch1][#C][N][C][C@@H1][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1][C][=N][N][=N][N][Ring1][Branch1][C][C][C][F]
|
[C@@H]18CC2CCC1CC2.Cn1nc9cc16.c17nnnn15.C5CCF.C19CC1.[C@@H]367.N34.C48
|
Cc1cnc(C(=O)N2C[C@H](F)[C@H](NC(=O)[C@@H](C(C)C)N3CCN(C)CC3)C2)nc1
|
CccncC=O)NC[C@H]F)[C@H]NC=O)[C@@H]CC)C))NCCNC)CC6)))))))))C5))))))nc6
|
[C][C][=C][N][=C][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][F][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][Ring2][N][=C][Ring2][Ring1][N]
|
Cc1cnc8nc1.N14C[C@@H]7[C@@H](F)C1.C5(=O)[C@H]6C(C)C.N16CCN(C)CC1.C48=O.N57
|
CCCC[C@H](CNC(=O)CCCCOC)NC(=O)CN1CCCS1(=O)=O
|
CCCC[C@H]CNC=O)CCCCOC)))))))))NC=O)CNCCCS5=O)=O
|
[C][C][C][C][C@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C][C][C][C][O][C][N][C][=Branch1][C][=O][C][N][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O]
|
CCCC[C@@H]5C6.C2(=O)CCCC4.N17CCCS1(=O)=O.C3(=O)C7.N26.O4C.N35
|
C[C@@H](NC(=O)C1(F)CCC(=O)CC1)[C@@H]1CCCN(C(=O)C=Cc2ccco2)C1
|
C[C@@H]NC=O)CF)CCC=O)CC6))))))))[C@@H]CCCNC=O)C=Ccccco5))))))))C6
|
[C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][Branch1][C][F][C][C][C][=Branch1][C][=O][C][C][Ring1][Branch2][C@@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][#C]
|
C16(F)CCC(=O)CC1.[C@@H]18CCCN4C1.C=7c1ccco1.C4(=O)C=7.C[C@@H]58.C36=O.N35
|
Cc1ccc(C(=O)N2CC3(C[C@@H](NC(=O)c4ccc(F)c(F)c4C)CO3)C2)s1
|
CccccC=O)NCCC[C@@H]NC=O)ccccF)cF)c6C)))))))))CO5))))C4)))))s5
|
[C][C][=C][C][=C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][C][C][O][Ring1][P][C][Ring2][Ring1][Ring2][S][Ring2][Ring1][O]
|
N15CC2(C[C@@H]7CO2)C1.c19ccc(F)c(F)c1C.Cc1ccc8s1.C58=O.C69=O.N67
|
COC[C@@H]1CN(C(=O)c2ccccc2C)CCN1C(=O)C[C@H](C)n1cccn1
|
COC[C@@H]CNC=O)cccccc6C))))))))CCN6C=O)C[C@H]C)ncccn5
|
[C][O][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][N][C][=C][C][=N][Ring1][Branch1]
|
[C@@H]18CN3CCN14.c16ccccc1C.C4(=O)C[C@@H]7C.n17cccn1.C36=O.CO5.C58
|
CCc1ccsc1C(=O)NC1(CNC(=O)c2cn(C)c(C)cc2=O)CCCCC1
|
CCcccsc5C=O)NCCNC=O)ccnC)cC)cc6=O))))))))))CCCCC6
|
[C][C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][C][Branch1][C][C][=C][C][Ring1][Branch2][=O][C][C][C][C][C][Ring2][Ring1][Ring1]
|
c18cn(C)c(C)cc1=O.C159CCCCC1.c1%10ccsc17.C37=O.C48=O.CC%10.N35.C69.N46
|
CCCC[C@H](CNC(=O)Cc1c(C)nn(C)c1C)NC(=O)Cc1ccc(Cl)cc1
|
CCCC[C@H]CNC=O)CccC)nnC)c5C))))))))))NC=O)CccccCl)cc6
|
[C][C][C][C][C@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
c16c(C)nn(C)c1C.CCCC[C@@H]4C5.c17ccc(Cl)cc1.C2(=O)C6.C3(=O)C7.N25.N34
|
CCOC[C@@H](C)C(=O)N[C@H]1CCC[C@H]1NC(=O)C1(C#N)CC2(CC2)C1
|
CCOC[C@@H]C)C=O)N[C@H]CCC[C@H]5NC=O)CC#N))CCCC3))C4
|
[C][C][O][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][Branch2]
|
C19(C#N)CC2(CC2)C1.C6[C@@H](C)C3=O.[C@H]17CCC[C@H]18.C49=O.CC5.O56.N37.N48
|
Cc1cccc2c1C[C@H](C(=O)NC/C=C/CNC(=O)c1cnc(Br)c(N)n1)O2
|
Ccccccc6C[C@H]C=O)NC/C=C/CNC=O)ccncBr)cN)n6))))))))))))))O5
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][/C][=C][/C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Br][C][Branch1][C][N][=N][Ring1][Branch2][O][Ring2][Ring1][#Branch1]
|
Cc1cccc2c1C[C@H]7O2.c18cnc(Br)c(N)n1.C37=O.C5C=9.C=9C6.C48=O.N35.N46
|
C[C@H]1CCN(C(=O)c2cc(C#N)c3n2CCCC3)C[C@@H]1CNC(=O)CC1(C)CC1
|
C[C@H]CCNC=O)cccC#N))cn5CCCC6))))))))))C[C@@H]6CNC=O)CCC)CC3
|
[C][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][#N][=C][N][Ring1][#Branch1][C][C][C][C][Ring1][=Branch1][C][C@@H1][Ring2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Ring1][Ring2]
|
c17cc(C#N)c2n1CCCC2.C[C@H]1CCN4C[C@@H]18.C5(=O)C9.C19(C)CC1.C47=O.C68.N56
|
FC(F)CN1CCC(N=c2[nH]c3c(c(=NC4CC(C5CC5)C4)[nH]2)SCC3)CC1
|
FCF)CNCCCN=c[nH]ccc=NCCCCCC3)))C4)))))[nH]6))SCC5))))))))CC6
|
[F][C][Branch1][C][F][C][N][C][C][C][Branch2][Ring2][C][N][=C][NH1][C][=C][Branch2][Ring1][Branch1][C][=Branch1][#C][=N][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][#Branch1][NH1][Ring1][=C][S][C][C][Ring1][#C][C][C][Ring2][Ring1][Branch2]
|
N16CCC(N=c2[nH]c3c(c(=NC4CC(C5CC5)C4)[nH]2)SCC3)CC1.FC(F)C6
|
Cc1ncnc(C)c1CC(=O)N1CC[C@H](N(C)C(=O)C=C2CCN(C)CC2)C1
|
CcncncC)c6CC=O)NCC[C@H]NC)C=O)C=CCCNC)CC6)))))))))C5
|
[C][C][=N][C][=N][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring1][P]
|
Cc1ncnc(C)c17.C1=6CCN(C)CC1.N13CC[C@H]5C1.C7C3=O.C4(=O)C=6.N45C
|
C[C@H](CNC(=O)c1ccc2c(c1)N(C)C(=O)C2)NC(=O)[C@H](N(C)C)C(C)(C)C
|
C[C@H]CNC=O)cccccc6)NC)C=O)C5)))))))))))NC=O)[C@H]NC)C))CC)C)C
|
[C][C@H1][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][Ring1][Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C]
|
c18ccc2c(c1)N(C)C(=O)C2.C4(=O)[C@H]7C(C)(C)C.C[C@@H]5C6.C38=O.N7(C)C.N36.N45
|
C[C@]1(NC(=O)c2nnn3c2CCCC3)CCCN(C(=O)c2ccc(CO)cc2)C1
|
C[C@]NC=O)cnnnc5CCCC6)))))))))))CCCNC=O)ccccCO))cc6)))))))C6
|
[C][C@][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][N][=N][N][C][=Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][O][C][=C][Ring1][Branch2][C][Ring2][Ring1][N]
|
c17nnn2c1CCCC2.C[C@]16CCCN5C1.c18ccc9cc1.C47=O.C58=O.N46.C9O
|
C=CC[C@@H](NC(=O)CSc1cn[nH]c1)C(=O)NC[C@H]1CC2(CCO1)CC2
|
C=CC[C@@H]NC=O)CSccn[nH]c5)))))))))C=O)NC[C@H]CCCCO6)))CC3
|
[C][=C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][S][C][C][=N][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch1]
|
[C@H]18CC2(CCO1)CC2.C=CC[C@@H]5C4=O.c19cn[nH]c1.C3(=O)C7.N35.S79.N46.C68
|
COCc1ccc(C(=O)N[C@H]2CN(C(=O)c3conc3C)CCC2(C)C)o1
|
COCccccC=O)N[C@H]CNC=O)cconc5C)))))))CCC6C)C)))))))))o5
|
[C][O][C][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][O][N][=C][Ring1][Branch1][C][C][C][C][Ring1][=C][Branch1][C][C][C][O][Ring2][Ring1][Branch2]
|
[C@H]17CN5CCC1(C)C.c1%10ccc8o1.c19conc1C.C48=O.C59=O.CO6.C6%10.N47
|
C#CCN(C(=O)CC[C@H]1CC[C@@H](NC(=O)C(=O)C2CCCC2)C1)C(C)C
|
C#CCNC=O)CC[C@H]CC[C@@H]NC=O)C=O)CCCCC5))))))))C5))))))))CC)C
|
[C][#C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][C][C@H1][C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][Ring1][#C][C][Branch1][C][C][C]
|
[C@H]19CC[C@@H]7C1.C3(=O)CC9.C4(=O)C8=O.C18CCCC1.C#CC5.N356.C6(C)C.N47
|
O=C([C@@H]1CC12CCOCC2)N1CC[C@H](N(CCO)C(=O)c2ccccn2)C1
|
O=C[C@@H]CC3CCOCC6))))))))NCC[C@H]NCCO)))C=O)cccccn6))))))))C5
|
[O][=C][Branch1][=N][C@@H1][C][C][Ring1][Ring1][C][C][O][C][C][Ring1][=Branch1][N][C][C][C@H1][Branch2][Ring1][Ring1][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][P]
|
[C@@H]18CC12CCOCC2.N13CC[C@H]6C1.c17ccccn1.O=C38.N456.C5CO.C47=O
|
CC(=O)c1cc(F)ccc1NS(=O)(=O)c1ccc(CC#N)cc1Cl
|
CC=O)cccF)ccc6NS=O)=O)ccccCC#N)))cc6Cl
|
[C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][C][C][#N][C][=C][Ring1][=Branch2][Cl]
|
S2(=O)(=O)c1ccc5cc1Cl.c14cc(F)ccc13.CC4=O.C5C#N.N23
|
CSCC(C)(C)C(=O)N1CCC[C@H](CNC(=O)c2cccn2C)C1
|
CSCCC)C)C=O)NCCC[C@H]CNC=O)ccccn5C)))))))))C6
|
[C][S][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][Ring1][S]
|
C6C(C)(C)C3=O.N13CCC[C@H]8C1.c17cccn1C.C47=O.CS6.C58.N45
|
CC(=O)N1CC(C(=O)N2CC[C@@](CO)(NC(=O)Cc3ccc(C(N)=O)cc3)C2)C1
|
CC=O)NCCC=O)NCC[C@@]CO))NC=O)CccccCN)=O))cc6)))))))))C5))))))C4
|
[C][C][=Branch1][C][=O][N][C][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C@@][Branch1][Ring1][C][O][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][Ring2][Ring1][Ring2][C][Ring2][Ring1][#Branch2]
|
N15CC[C@]7%10C1.c1%11ccc9cc1.N14CC8C1.C6(=O)C%11.CC4=O.C58=O.C9(N)=O.C%10O.N67
|
Cc1scnc1C(=O)NC1[C@@H]2CC(NC(=O)c3ccc(C(N)=O)cc3)C[C@@H]12
|
Ccscnc5C=O)NC[C@@H]CCNC=O)ccccCN)=O))cc6))))))))C[C@@H]65
|
[C][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][C@@H1][Ring2][Ring1][C][Ring1][P]
|
C16[C@@H]2CC7C[C@@H]12.c19ccc%10cc1.Cc1scnc18.C48=O.C59=O.C%10(N)=O.N46.N57
|
O=C(c1cc2c(s1)CCC2)N1CC[C@H]2CCN(C(=O)[C@H]3CCc4nccn43)[C@H]2C1
|
O=Cccccs5)CCC5)))))))NCC[C@H]CCNC=O)[C@H]CCcnccn58)))))))))[C@H]5C9
|
[O][=C][Branch1][#C][C][=C][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][Ring1][=Branch1][N][C][C][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C][C][=N][C][=C][N][Ring1][Branch1][Ring1][Branch2][C@H1][Ring1][#C][C][Ring2][Ring1][Ring1]
|
N15CC[C@H]2CCN6[C@H]2C1.C6(=O)[C@H]1CCc2nccn21.c17cc2c(s1)CCC2.O=C57
|
C[C@H](CCN1CCCC1)NC(=O)[C@H](CCN(C)C)NC(=O)Cc1ccsc1
|
C[C@H]CCNCCCC5)))))))NC=O)[C@H]CCNC)C))))NC=O)Ccccsc5
|
[C][C@H1][Branch1][#Branch2][C][C][N][C][C][C][C][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][N][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=Ring1][Branch1]
|
C2(=O)[C@@H]6CC7.C[C@@H]4CC5.N15CCCC1.c18ccsc1.C3(=O)C8.N7(C)C.N24.N36
|
C=C=CCCC(=O)N1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C)n2)C[C@@]12CCOC2
|
C=C=CCCC=O)NC[C@H]NC=O)ccc[N+]=O)[O-]))ccC)n6))))))))C[C@@]5CCOC5
|
[C][=C][=C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][Branch1][C][C][=N][Ring1][#Branch2][C][C@@][Ring2][Ring1][C][C][C][O][C][Ring1][Branch1]
|
N13C[C@H]5C[C@@]12CCOC2.c16cc([N+](=O)[O-])cc(C)n1.C=C=CCCC3=O.C46=O.N45
|
CC[C@@H](O)CC(=O)N1CC2(C1)[C@@H](NC(=O)c1scnc1Cl)CCS2(=O)=O
|
CC[C@@H]O)CC=O)NCCC4)[C@@H]NC=O)cscnc5Cl))))))))CCS5=O)=O
|
[C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][S][C][=N][C][=Ring1][Branch1][Cl][C][C][S][Ring1][#C][=Branch1][C][=O][=O]
|
N13CC2(C1)[C@@H]5CCS2(=O)=O.CC[C@@H](O)CC3=O.c16scnc1Cl.C46=O.N45
|
CC1(C)CCN(C(=O)C2CC(=O)C2)[C@@H](C(=O)NC[C@@H](O)c2cccnc2)C1
|
CCC)CCNC=O)CCC=O)C4)))))[C@@H]C=O)NC[C@@H]O)ccccnc6))))))))))C6
|
[C][C][Branch1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][Ring1][Branch1][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
CC1(C)CCN3[C@@H]6C1.c18cccnc1.C17CC(=O)C1.C5[C@H]8O.C37=O.C46=O.N45
|
COc1ccccc1[C@@H](CC(=O)O)NC(=O)[C@@H](F)CC1CC1
|
COcccccc6[C@@H]CC=O)O)))NC=O)[C@@H]F)CCCC3
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][C][C][Ring1][Ring1]
|
c13ccccc16.[C@H]46CC(=O)O.C2(=O)[C@@H](F)C5.C15CC1.CO3.N24
|
CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H]1CNC(=O)CCCCCS(N)(=O)=O
|
CC=O)N[C@H]CCC)C)))C=O)N[C@@H]C[C@@H]3CNC=O)CCCCCSN)=O)=O
|
[C][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][C][S][Branch1][C][N][=Branch1][C][=O][=O]
|
C4(=O)CCCCCS(N)(=O)=O.[C@@H]5(CC(C)C)C3=O.[C@@H]17C[C@@H]18.CC2=O.N25.N37.C68.N46
|
Cc1nc(NC(C)(C)CNC(=O)COC2CCCCCC2)c2ccsc2n1
|
CcncNCC)C)CNC=O)COCCCCCCC7))))))))))))))cccsc5n9
|
[C][C][=N][C][Branch2][Ring1][#Branch2][N][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][O][C][C][C][C][C][C][C][Ring1][#Branch1][=C][C][=C][S][C][Ring1][Branch1][=N][Ring2][Ring1][#Branch2]
|
Cc1nc8c2ccsc2n1.C15CCCCCC1.C6(C)(C)C7.C3(=O)C4.N68.N37.O45
|
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