SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CNC(=O)C(C)(C)C(=O)NC[C@@H]1CN(C(=O)CC[C@@H]2NC(=O)NC2=O)C(C)(C)C1
|
CNC=O)CC)C)C=O)NC[C@@H]CNC=O)CC[C@@H]NC=O)NC5=O)))))))))CC)C)C5
|
[C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C@@H1][N][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][C]
|
C3(=O)C(C)(C)C4=O.[C@@H]18CN5C(C)(C)C1.[C@@H]17NC(=O)NC1=O.C5(=O)CC7.CN3.N46.C68
|
CCCN(C)CC(=O)N1CCN(C(=O)c2ccnc3c2ncn3C)C[C@H]1COC
|
CCCNC)CC=O)NCCNC=O)cccncc6ncn5C)))))))))))C[C@H]6COC
|
[C][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][C@H1][Ring2][Ring1][C][C][O][C]
|
c19ccnc2c1ncn2C.N14CCN5C[C@H]1%10.C8C4=O.CCC7.N78C.C59=O.C6%10.O6C
|
CCOC[C@H]1CCCN(C(=O)CCn2cc(C3C(C)(C)C3(C)C)nn2)C1
|
CCOC[C@H]CCCNC=O)CCnccCCC)C)C3C)C))))nn5))))))))C6
|
[C][C][O][C][C@H1][C][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][S][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch1][Branch1][C][C][C][N][=N][Ring1][N][C][Ring2][Ring1][=Branch1]
|
[C@H]18CCCN4C1.C19C(C)(C)C1(C)C.n17cc9nn1.C4(=O)CC7.CC5.O56.C68
|
CCOC(=O)CCC(=O)N[C@@H]1CC[C@H]2CCN(C(=O)C[C@H](C)c3ccco3)[C@H]21
|
CCOC=O)CCC=O)N[C@@H]CC[C@H]CCNC=O)C[C@H]C)cccco5))))))))[C@H]58
|
[C][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C][=C][C][=C][O][Ring1][Branch1][C@H1][Ring1][#C][Ring2][Ring1][C]
|
[C@@H]18CC[C@H]2CCN6[C@H]21.C4(=O)CCC5=O.C6(=O)C[C@@H]9C.c19ccco1.CC7.O47.N58
|
CN(CCC(=O)N1CCC[C@@H]2C[C@@H]21)C(=O)C=CC1CCCC1
|
CNCCC=O)NCCC[C@@H]C[C@@H]37))))))))))C=O)C=CCCCCC5
|
[C][N][Branch2][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][C][C@@H1][Ring1][Ring1][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][C][C][C][C][Ring1][Branch1]
|
N13CCC[C@@H]2C[C@@H]21.C=6C1CCCC1.C5CC3=O.C4(=O)C=6.CN45
|
CN(C)[C@@](C)(CC(=O)N[C@H]1C[C@H](CNC(=O)Cc2cc[nH]n2)[C@H](O)C1)C(F)(F)F
|
CNC)[C@@]C)CC=O)N[C@H]C[C@H]CNC=O)Cccc[nH]n5)))))))))[C@H]O)C5))))))))CF)F)F
|
[C][N][Branch1][C][C][C@@][Branch1][C][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][C][=C][NH1][N][=Ring1][Branch1][C@H1][Branch1][C][O][C][Ring1][S][C][Branch1][C][F][Branch1][C][F][F]
|
[C@@]5(C)(CC3=O)C(F)(F)F.[C@@H]17C[C@@H](O)[C@@H]9C1.c18cc[nH]n1.C4(=O)C8.CN5C.N37.C69.N46
|
COc1cc(C2(C(=O)NCC[C@@H](F)Cn3cc(CC(C)C)nn3)CC2)ccc1Cl
|
COcccCC=O)NCC[C@@H]F)CnccCCC)C)))nn5)))))))))))CC3)))ccc6Cl
|
[C][O][C][=C][C][Branch2][Ring2][Branch1][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][F][C][N][C][=C][Branch1][#Branch1][C][C][Branch1][C][C][C][N][=N][Ring1][=Branch2][C][C][Ring2][Ring1][Ring2][=C][C][=C][Ring2][Ring1][#Branch2][Cl]
|
c15cc%10ccc1Cl.C6C[C@@H](F)C8.n18cc9nn1.C17%10CC1.C9C(C)C.C47=O.CO5.N46
|
C#C[C@H]1[C@H](C(=O)NCCCN(C)C(=O)Cc2ccc3nsnc3c2)C1(C)C
|
C#C[C@H][C@H]C=O)NCCCNC)C=O)Cccccnsnc5c9)))))))))))))))))C3C)C
|
[C][#C][C@H1][C@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][C][=N][S][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C][Ring2][Ring1][#Branch1][Branch1][C][C][C]
|
c19ccc2nsnc2c1.C#C[C@H]1[C@H]8C1(C)C.C6CC7.C5(=O)C9.C48=O.N57C.N46
|
O=C(C#C[C@@H]1CCOC1)NC[C@H]1CCO[C@H]1C(=O)NCCc1nccc(O)n1
|
O=CC#C[C@@H]CCOC5)))))))NC[C@H]CCO[C@H]5C=O)NCCcncccO)n6
|
[O][=C][Branch1][#Branch2][C][#C][C@@H1][C][C][O][C][Ring1][Branch1][N][C][C@H1][C][C][O][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=C][C][Branch1][C][O][=N][Ring1][#Branch1]
|
O=C2C#C[C@@H]1CCOC1.c17nccc(O)n1.[C@H]18CCO[C@H]16.C36=O.C5C7.N24.C48.N35
|
Cc1nc(C)c(CNC(=NCCN2CCc3c(Cl)cccc3C2=O)NC2CC2)s1
|
CcncC)cCNC=NCCNCCccCl)cccc6C%10=O))))))))))))))NCCC3)))))))s5
|
[C][C][=N][C][Branch1][C][C][=C][Branch2][Ring2][C][C][N][C][=Branch2][Ring1][=Branch1][=N][C][C][N][C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][C][Ring1][O][=O][N][C][C][C][Ring1][Ring1][S][Ring2][Ring1][N]
|
N16CCc2c(Cl)cccc2C1=O.N4C(=NCC6)N5.Cc1nc(C)c7s1.C15CC1.C47
|
CSCC[C@H](NC(=O)[C@H](C)OC(C)(C)C)C(=O)N1CCN(CCO)CC1
|
CSCC[C@H]NC=O)[C@H]C)OCC)C)C))))))C=O)NCCNCCO)))CC6
|
[C][S][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][Ring2][C][C][O][C][C][Ring1][=Branch2]
|
C8C[C@H]6C3=O.N13CCN7CC1.C2(=O)[C@@H]4C.C5(C)(C)C.C7CO.CS8.N26.O45
|
Cc1ccc(CC(=O)N2C[C@@H](C(=O)N3CCC[C@H]4CCCC[C@@H]43)O[C@@H](C)C2)cc1
|
CccccCC=O)NC[C@@H]C=O)NCCC[C@H]CCCC[C@@H]6%10)))))))))))O[C@@H]C)C6))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][Ring1][#Branch2][O][C@@H1][Branch1][C][C][C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][N]
|
N16CCC[C@H]2CCCC[C@@H]21.N15C[C@@H]7O[C@@H](C)C1.Cc1ccc8cc1.C8C5=O.C67=O
|
O=C(C[C@H]1CCCN(C(=O)Cc2cc[nH]n2)CC1)NC[C@@H]1CC12CCC2
|
O=CC[C@H]CCCNC=O)Cccc[nH]n5)))))))CC7))))))))NC[C@@H]CC3CCC4
|
[O][=C][Branch2][Ring1][=Branch2][C][C@H1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][NH1][N][=Ring1][Branch1][C][C][Ring1][#C][N][C][C@@H1][C][C][Ring1][Ring1][C][C][C][Ring1][Ring2]
|
[C@H]17CCCN4CC1.[C@@H]18CC12CCC2.c16cc[nH]n1.O=C3C7.C4(=O)C6.N35.C58
|
CN1CC[C@H](C(=O)NCCN(C(=O)c2nccc(Cl)c2F)C2CC2)S1(=O)=O
|
CNCC[C@H]C=O)NCCNC=O)cncccCl)c6F))))))))CCC3))))))))S5=O)=O
|
[C][N][C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][C][C][C][Ring1][Ring1][S][Ring2][Ring1][Branch2][=Branch1][C][=O][=O]
|
CN1CC[C@H]8S1(=O)=O.c19nccc(Cl)c1F.C38=O.C5C6.N467.C49=O.C17CC1.N35
|
O=C(NCC[C@@H]1CCCN(C(=O)Cc2cn3ccsc3n2)C1)[C@H](F)CC1CCC1
|
O=CNCC[C@@H]CCCNC=O)Cccnccsc5n8))))))))))C6)))))))))[C@H]F)CCCCC4
|
[O][=C][Branch2][Ring1][S][N][C][C][C@@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][N][C][=C][S][C][Ring1][Branch1][=N][Ring1][Branch2][C][Ring1][P][C@H1][Branch1][C][F][C][C][C][C][C][Ring1][Ring2]
|
c17cn2ccsc2n1.[C@@H]18CCCN5C1.O=C4[C@H](F)C9.C5(=O)C7.C19CCC1.C6C8.N46
|
CC(Cl)=CC(=O)N1C[C@@H]2CC[C@]2(NC(=O)C2=CSCS2)C1
|
CCCl)=CC=O)NC[C@@H]CC[C@]4NC=O)C=CSCS5)))))))C7
|
[C][C][Branch1][C][Cl][=C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][=N][N][C][=Branch1][C][=O][C][=C][S][C][S][Ring1][Branch1][C][Ring1][#C]
|
N13C[C@@H]2CC[C@]25C1.C4(=O)C1=CSCS1.C=6C3=O.CC=6Cl.N45
|
CCN(C[C@@H]1CCCN(C(=O)[C@H]2C[C@H]3C=C[C@@H]2CC3)C1)C(=O)CCn1cncn1
|
CCNC[C@@H]CCCNC=O)[C@H]C[C@H]C=C[C@@H]6CC6)))))))))C6)))))))C=O)CCncncn5
|
[C][C][N][Branch2][Ring1][N][C][C@@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C@H1][C][=C][C@@H1][Ring1][=Branch1][C][C][Ring1][=Branch1][C][Ring1][S][C][=Branch1][C][=O][C][C][N][C][=N][C][=N][Ring1][Branch1]
|
[C@H]18C[C@H]2C=C[C@@H]1CC2.[C@@H]1%10CCCN4C1.C5(=O)CC9.n19cncn1.N567.C48=O.CC6.C7%10
|
N#Cc1cc2c(nc1N1C[C@@H]3C[C@H]1CN3C(=O)C(F)(F)F)CCC2
|
N#Cccccnc6NC[C@@H]C[C@H]5CN5C=O)CF)F)F))))))))))))CCC5
|
[N][#C][C][=C][C][=C][Branch2][Ring1][N][N][=C][Ring1][=Branch1][N][C][C@@H1][C][C@H1][Ring1][Branch1][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][C][C][Ring2][Ring1][Ring2]
|
N#Cc1cc2c(nc15)CCC2.N15C[C@@H]2C[C@H]1CN24.C4(=O)C(F)(F)F
|
COc1cc(C)c(CN2CC[C@@H](O)[C@H](C(=O)Nc3cnc(Cl)cc3Cl)C2)c(O)c1
|
COcccC)cCNCC[C@@H]O)[C@H]C=O)NccncCl)cc6Cl)))))))))C6)))))))cO)c6
|
[C][O][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][C][C][N][C][C][C@@H1][Branch1][C][O][C@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][Ring2][Ring1][C][C][Branch1][C][O][=C][Ring2][Ring1][O]
|
c15cc(C)c9c(O)c1.N16CC[C@@H](O)[C@H]8C1.c17cnc(Cl)cc1Cl.C48=O.CO5.C69.N47
|
CCc1cc(C(=O)N[C@@H]2CC[C@H](CNC(=O)C3CCC=CCC3)C2)ccc1O
|
CCcccC=O)N[C@@H]CC[C@H]CNC=O)CCCC=CCC7))))))))))C5)))))))ccc6O
|
[C][C][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][C][C][=C][C][C][Ring1][#Branch1][C][Ring1][S][=C][C][=C][Ring2][Ring1][=Branch2][O]
|
c1%11cc9ccc1O.C18CCC=CCC1.[C@@H]17CC[C@H]%10C1.C49=O.C58=O.CC%11.N47.C6%10.N56
|
Cc1cc(C)c(CNC[C@@H](C#N)CCC#N)cn1
|
CcccC)cCNC[C@@H]C#N))CCC#N))))))))cn6
|
[C][C][=C][C][Branch1][C][C][=C][Branch1][=N][C][N][C][C@@H1][Branch1][Ring1][C][#N][C][C][C][#N][C][=N][Ring1][P]
|
Cc1cc(C)c4cn1.C3[C@@H](C#N)CCC#N.C24.N23
|
Cc1nnn(CC(=O)NCC[C@H]2CC[C@H](NC(=O)c3ccc(=O)oc3)C2)n1
|
CcnnnCC=O)NCC[C@H]CC[C@H]NC=O)cccc=O)oc6))))))))C5))))))))))n5
|
[C][C][N][=N][N][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][O][C][=Ring1][#Branch1][C][Ring1][#C][N][=Ring2][Ring1][#Branch2]
|
c18ccc(=O)oc1.Cc1nnn9n1.[C@H]1%10CC[C@H]7C1.C9C4=O.C6C%10.C58=O.N46.N57
|
CC=C(C)C(=O)NC[C@]1(NC(=O)[C@H](CC)CC(F)(F)F)CCCC[C@H]1C
|
CC=CC)C=O)NC[C@]NC=O)[C@H]CC))CCF)F)F))))))CCCC[C@H]6C
|
[C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][C][C][C@H1][Ring1][P][C]
|
C3(=O)[C@H](CC)CC(F)(F)F.[C@]157CCCC[C@H]1C.C=6(C)C2=O.CC=6.N24.C47.N35
|
C[C@@]1(CNC(=O)CCF)CC[C@H](NC(=O)c2cccc(CN3CCOCC3)c2)C1
|
C[C@@]CNC=O)CCF))))))CC[C@H]NC=O)cccccCNCCOCC6)))))))c6))))))))C5
|
[C][C@@][Branch1][#Branch2][C][N][C][=Branch1][C][=O][C][C][F][C][C][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][=C][Ring1][=N][C][Ring2][Ring1][N]
|
C[C@@]1%10CC[C@H]8C1.c19cccc%11c1.N17CCOCC1.C4(=O)CCF.C59=O.C6%10.N46.N58.C7%11
|
COC(=O)C1(C(=O)N2CC[C@@H]2CNC(=O)c2cccc(-n3ccnc3O)c2)CC1
|
COC=O)CC=O)NCC[C@@H]4CNC=O)ccccc-nccnc5O))))))c6))))))))))))))CC3
|
[C][O][C][=Branch1][C][=O][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][N][C][=C][N][=C][Ring1][Branch1][O][=C][Ring1][N][C][C][Ring2][Ring1][=Branch2]
|
c1%10cccc%12c1.n1%12ccnc1O.N15CC[C@@H]1%11.C189CC1.C48=O.C59=O.C6%10=O.CO4.C7%11.N67
|
O=C(C[C@H]1CCCC[C@@H]1O)NC1CN(C(=O)Cc2ccccc2Cl)C1
|
O=CC[C@H]CCCC[C@@H]6O))))))))NCCNC=O)Ccccccc6Cl)))))))))C4
|
[O][=C][Branch1][O][C][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Ring1][=C]
|
[C@H]16CCCC[C@@H]1O.c17ccccc1Cl.C15CN4C1.O=C3C6.C4(=O)C7.N35
|
C[C@@H](N[C@H](c1ccc(C(N)=O)cc1)c1nnnn1C1COC1)C1(C)COC1
|
C[C@@H]N[C@H]ccccCN)=O))cc6))))))cnnnn5CCOC4)))))))))))CC)COC4
|
[C][C@@H1][Branch2][Ring1][P][N][C@H1][Branch1][S][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][=N][N][=N][N][Ring1][Branch1][C][C][O][C][Ring1][Ring2][C][Branch1][C][C][C][O][C][Ring1][Branch1]
|
c17ccc4cc1.c15nnnn18.C16(C)COC1.C18COC1.C[C@@H]26.[C@H]357.C4(N)=O.N23
|
O=C(c1c(O)cccc1F)N1CCC[C@@H](N(CCF)C(=O)C=Cc2cnc[nH]2)C1
|
O=CccO)cccc6F)))))))NCCC[C@@H]NCCF)))C=O)C=Cccnc[nH]5)))))))))C6
|
[O][=C][Branch1][=N][C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][F][N][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][Branch1][Ring2][C][C][F][C][=Branch1][C][=O][C][=C][C][=C][N][=C][NH1][Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
c17c(O)cccc1F.N13CCC[C@@H]6C1.C=8c1cnc[nH]1.C4(=O)C=8.O=C37.N456.C5CF
|
Cc1cc(C(=O)NC23CC(CNC(=O)c4c[nH]c(=O)cn4)(C2)C3)cc(C)c1F
|
CcccC=O)NCCCCNC=O)cc[nH]c=O)cn6)))))))))C4)C4))))))ccC)c6F
|
[C][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=O][C][=N][Ring1][#Branch1][Branch1][Ring2][C][Ring1][#C][C][Ring1][S][=C][C][Branch1][C][C][=C][Ring2][Ring1][#Branch2][F]
|
Cc1cc%10cc(C)c1F.c19c[nH]c(=O)cn1.C128CC%11(C1)C2.C5%10=O.C69=O.N58.C7%11.N67
|
CC(C)C1(CNC(=O)CCN(CCCO)C(=O)C[C@H]2C[C@@H]2C2CC2)CC1
|
CCC)CCNC=O)CCNCCCO))))C=O)C[C@H]C[C@@H]3CCC3))))))))))))))CC3
|
[C][C][Branch1][C][C][C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C][C][N][Branch1][Branch1][C][C][C][O][C][=Branch1][C][=O][C][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][#Branch1]
|
[C@H]1%10C[C@@H]1C1CC1.C3(=O)CC6.C189CC1.C7CCO.C4(=O)C%10.CC8C.N467.C59.N35
|
COc1cccnc1C(=O)NCC[C@@H](NC(=O)CC[C@H]1CC1(C)C)C(C)C
|
COccccnc6C=O)NCC[C@@H]NC=O)CC[C@H]CC3C)C))))))))CC)C
|
[C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][C@H1][C][C][Ring1][Ring1][Branch1][C][C][C][C][Branch1][C][C][C]
|
c14cccnc17.C5C[C@@H]6C(C)C.C3(=O)CC8.[C@H]18CC1(C)C.C27=O.CO4.N25.N36
|
C[C@@H](C(=O)N(C)CC1(NC(=O)CCC(=O)c2cccs2)CC1)N1CCOCC1
|
C[C@@H]C=O)NC)CCNC=O)CCC=O)ccccs5))))))))))CC3))))))NCCOCC6
|
[C][C@@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][#C][N][C][C][O][C][C][Ring1][=Branch1]
|
C4(=O)CCC8=O.N15CCOCC1.C[C@H]5C3=O.c18cccs1.C179CC1.N36C.C69.N47
|
Cc1ccc(F)c(C(=O)N2CCOCC[C@@H]2C(=O)N[C@H]2CCc3ncnn3C2)n1
|
CccccF)cC=O)NCCOCC[C@@H]7C=O)N[C@H]CCcncnn5C9)))))))))))))))))))n6
|
[C][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][O][C][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C][=N][C][=N][N][Ring1][Branch1][C][Ring1][=Branch2][=N][Ring2][Ring1][N]
|
[C@H]16CCc2ncnn2C1.Cc1ccc(F)c8n1.N14CCOCC[C@@H]17.C48=O.C57=O.N56
|
O=C(c1cnn[nH]1)N1CCN(C(=O)c2ccc3sccc3c2)[C@@H](CC(F)(F)F)C1
|
O=Cccnn[nH]5)))))NCCNC=O)ccccsccc5c9))))))))))[C@@H]CCF)F)F)))C6
|
[O][=C][Branch1][Branch2][C][=C][N][=N][NH1][Ring1][Branch1][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][S][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C@@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][=Branch1]
|
c17ccc2sccc2c1.N14CCN5[C@@H]8C1.c16cnn[nH]1.C8C(F)(F)F.O=C46.C57=O
|
C[C@@H](C(=O)N1CC[C@@H](CN(C)C(=O)Cc2cnns2)C1)c1c[nH]c2ccccc12
|
C[C@@H]C=O)NCC[C@@H]CNC)C=O)Cccnns5)))))))))C5))))))cc[nH]cccccc96
|
[C][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][N][=N][S][Ring1][Branch1][C][Ring1][S][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]
|
c18c[nH]c2ccccc12.N13CC[C@@H]7C1.C[C@H]8C3=O.c16cnns1.C4(=O)C6.N45C.C57
|
C=C[C@H](CC)CC(=O)NC[C@@H](NC(=O)c1csc(Cl)c1Cl)C(C)C
|
C=C[C@H]CC))CC=O)NC[C@@H]NC=O)ccscCl)c5Cl))))))))CC)C
|
[C][=C][C@H1][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Cl][=C][Ring1][=Branch1][Cl][C][Branch1][C][C][C]
|
C=C[C@H](CC)CC2=O.c16csc(Cl)c1Cl.C4[C@@H]5C(C)C.C36=O.N24.N35
|
CCSc1cc(C(=O)N[C@@H]2COCC[C@@H]2NC(=O)[C@@H]2CCC(C)(C)C2)ccn1
|
CCScccC=O)N[C@@H]COCC[C@@H]6NC=O)[C@@H]CCCC)C)C5)))))))))))))))ccn6
|
[C][C][S][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][O][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][=C][C][=N][Ring2][Ring1][=Branch2]
|
c1%10cc9ccn1.[C@@H]16COCC[C@@H]17.[C@@H]18CCC(C)(C)C1.C39=O.C48=O.CC5.S5%10.N36.N47
|
N#Cc1ccc2oc(-c3cnc(CC(=O)Nc4ccnc(O)c4)nc3)cc2c1
|
N#Cccccoc-ccncCC=O)NcccncO)c6)))))))))nc6))))))cc5c9
|
[N][#C][C][=C][C][=C][O][C][Branch2][Ring1][=N][C][=C][N][=C][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][=C][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][N][=C][Ring1][P][=C][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2]
|
N#Cc1ccc2oc8cc2c1.c18cnc7nc1.c16ccnc(O)c1.C7C5=O.N56
|
CC[C@H](C)C[C@H](C)N(C)[C@@H](C(=O)Nc1ccc(F)cc1)c1cccc(OC)c1C
|
CC[C@H]C)C[C@H]C)NC)[C@@H]C=O)NccccF)cc6))))))))cccccOC))c6C
|
[C][C][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][N][Branch1][C][C][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C]
|
c17cccc3c1C.CC[C@H](C)C[C@@H]4C.c16ccc(F)cc1.[C@@H]57C2=O.N45C.N26.O3C
|
Cc1nc(C2(NC(=O)[C@@H](C)CN(C)C(=O)CC3CC(N(C)C)C3)CC2)n[nH]1
|
CcncCNC=O)[C@@H]C)CNC)C=O)CCCCNC)C))C4)))))))))))CC3)))n[nH]5
|
[C][C][=N][C][Branch2][Ring2][#Branch2][C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][#Branch1][C][C][Ring2][Ring1][Branch1][=N][NH1][Ring2][Ring1][#Branch2]
|
Cc1nc%10n[nH]1.C4(=O)[C@@H](C)C7.C19CC8C1.C16%10CC1.C5(=O)C9.N57C.N8(C)C.N46
|
CC(=O)N(C)Cc1cn(C[C@@H]2CCCCN(C(=O)CN3CCCCC3)C2)nn1
|
CC=O)NC)CccnC[C@@H]CCCCNC=O)CNCCCCC6))))))))C7))))))))nn5
|
[C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][N][Branch2][Ring1][#Branch2][C][C@@H1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][N][C][C][C][C][C][Ring1][=Branch1][C][Ring1][S][N][=N][Ring2][Ring1][=Branch1]
|
[C@@H]1%10CCCCN5C1.c19cn8nn1.N17CCCCC1.C5(=O)C7.CC4=O.N46C.C69.C8%10
|
Cn1nc(O)cc1C(=O)N1CC([C@@H](F)Cn2cc(CCC#N)nn2)C1
|
CnncO)cc5C=O)NCC[C@@H]F)CnccCCC#N))))nn5)))))))C4
|
[C][N][N][=C][Branch1][C][O][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][C@@H1][Branch1][C][F][C][N][C][=C][Branch1][Branch1][C][C][C][#N][N][=N][Ring1][=Branch2][C][Ring1][S]
|
Cn1nc(O)cc14.n15cc6nn1.N13CC7C1.[C@H]7(F)C5.C6CC#N.C34=O
|
CO[C@H](C)CC(=O)N1CCN(C2CN(C(=O)CCCc3ncc(C)o3)C2)CC1
|
CO[C@H]C)CC=O)NCCNCCNC=O)CCCcnccC)o5)))))))))C4))))CC6
|
[C][O][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][C][=N][C][=C][Branch1][C][C][O][Ring1][=Branch1][C][Ring1][#C][C][C][Ring2][Ring1][Branch1]
|
N14CCN7CC1.[C@@H]6(C)CC4=O.C5(=O)CCC8.c18ncc(C)o1.C17CN5C1.CO6
|
COc1cccc(OCCN=C(NCC2CC2)NC[C@@H]2CCCSC2)c1O
|
COcccccOCCN=CNCCCC3)))))NC[C@@H]CCCSC6)))))))))))))c6O
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][=Branch2][O][C][C][N][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Ring1][N][C][C@@H1][C][C][C][S][C][Ring1][=Branch1][=C][Ring2][Ring1][Branch2][O]
|
c14cccc5c1O.C3CN=C(N6)N7.[C@@H]19CCCSC1.C18CC1.CO4.O35.C68.C79
|
CC#C[C@@H](CC(=O)N1CCn2cnc(-c3ccnnc3)c2C1)c1ccc(O)cc1
|
CC#C[C@@H]CC=O)NCCncnc-cccnnc6))))))c5C9)))))))))))ccccO)cc6
|
[C][C][#C][C@@H1][Branch2][Ring1][=N][C][C][=Branch1][C][=O][N][C][C][N][C][=N][C][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][=C][Ring1][O][C][Ring1][#C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]
|
N14CCn2cnc6c2C1.CC#C[C@H]5CC4=O.c15ccc(O)cc1.c16ccnnc1
|
CCSCCCNC(=O)[C@H]([C@@H]1CCC2(CC2)C1)N1CCC(c2nnn(C)n2)CC1
|
CCSCCCNC=O)[C@H][C@@H]CCCCC3))C5)))))NCCCcnnnC)n5)))))CC6
|
[C][C][S][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=C][C@@H1][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][#Branch1][N][C][C][C][Branch1][O][C][N][=N][N][Branch1][C][C][N][=Ring1][=Branch1][C][C][Ring1][N]
|
[C@@H]18CCC2(CC2)C1.N15CCC9CC1.c19nnn(C)n1.C3(=O)[C@@H]58.C7CC4.CC6.S67.N34
|
COC1([C@H](C)NC(=O)C(=O)N2[C@@H](CO)CC[C@H]2c2cn(C)nc2C)CCOCC1
|
COC[C@H]C)NC=O)C=O)N[C@@H]CO))CC[C@H]5ccnC)nc5C)))))))))))))))CCOCC6
|
[C][O][C][Branch2][Ring2][Ring2][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][C][C@H1][Ring1][#Branch1][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][C][C][C][O][C][C][Ring2][Ring1][O]
|
C158CCOCC1.N14[C@H]9CC[C@@H]17.c19cn(C)nc1C.C3(=O)C4=O.[C@@H]68C.CO5.N36.C7O
|
CC(C)[C@H](CNC(=O)[C@@H]1CCC1(C)C)NC(=O)c1cccc(OC(F)(F)F)c1F
|
CCC)[C@H]CNC=O)[C@@H]CCC4C)C))))))))NC=O)cccccOCF)F)F)))c6F
|
[C][C][Branch1][C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][Ring1][Ring2][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][F]
|
c18cccc4c1F.CC(C)[C@@H]5C6.[C@@H]17CCC1(C)C.O4C(F)(F)F.C27=O.C38=O.N26.N35
|
C[C@H](NC(=O)c1cocc1Br)[C@@H](c1ccccc1)N1CCOCC1
|
C[C@H]NC=O)ccocc5Br))))))))[C@@H]cccccc6))))))NCCOCC6
|
[C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][Br][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][O][C][C][Ring1][=Branch1]
|
c15cocc1Br.c16ccccc1.N14CCOCC1.C[C@H]3[C@H]46.C25=O.N23
|
Nc1ccc(C(=O)NC[C@@]2(F)CC[C@H](NC(=O)c3cccc(CO)c3)C2)c(O)c1
|
NccccC=O)NC[C@@]F)CC[C@H]NC=O)cccccCO))c6))))))))C5))))))))cO)c6
|
[N][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][F][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][O][=C][Ring1][Branch2][C][Ring1][P][C][Branch1][C][O][=C][Ring2][Ring1][N]
|
Nc1ccc8c(O)c1.[C@]1%10(F)CC[C@H]7C1.c19cccc%11c1.C48=O.C59=O.N46.C6%10.N57.C%11O
|
COC(=O)NCC(=O)N1C[C@@H]2CC[C@]2(CNC(=O)C[C@H](C)n2cccc2)C1
|
COC=O)NCC=O)NC[C@@H]CC[C@]4CNC=O)C[C@H]C)ncccc5))))))))))C7
|
[C][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][N][C][=C][C][=C][Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
N15C[C@@H]2CC[C@]2%10C1.C6(=O)C[C@@H]9C.n19cccc1.C7C5=O.C34=O.CO3.N47.C8%10.N68
|
COc1ccc(C)c(C(=O)NC23CC(NC(=O)Cc4ccccc4SC)(C2)C3)c1
|
COccccC)cC=O)NCCCNC=O)Ccccccc6SC)))))))))))C4)C4))))))c6
|
[C][O][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][P][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][Branch1][Ring2][C][Ring1][S][C][Ring1][P][=C][Ring2][Ring1][O]
|
c17ccc(C)c%10c1.c1%11ccccc1%12.C128CC9(C1)C2.C6(=O)C%11.C5%10=O.CO7.N58.N69.S%12C
|
CC[C@H]1C[C@@H](C(=O)N[C@H](CO)[C@H](C)NC(=O)Cc2csc(C)n2)CC(=O)N1
|
CC[C@H]C[C@@H]C=O)N[C@H]CO))[C@H]C)NC=O)CccscC)n5))))))))))))CC=O)N6
|
[C][C][C@H1][C][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring2][Ring1][=Branch2]
|
[C@H]18C[C@@H]7CC(=O)N1.[C@@H]5(CO)[C@@H]6C.c19csc(C)n1.C4(=O)C9.C37=O.CC8.N35.N46
|
O=C(NCCc1ccccn1)[C@@H]1[C@@H]2C[C@H](F)[C@H](C2)N1C(=O)C(F)(F)Cl
|
O=CNCCcccccn6)))))))))[C@@H][C@@H]C[C@H]F)[C@H]C5)N6C=O)CF)F)Cl
|
[O][=C][Branch1][N][N][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C@@H1][C@@H1][C][C@H1][Branch1][C][F][C@H1][Branch1][Ring2][C][Ring1][=Branch1][N][Ring1][Branch2][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][Cl]
|
[C@@H]16[C@@H]2C[C@H](F)[C@H](C2)N14.c17ccccn1.C4(=O)C(F)(F)Cl.O=C36.C5C7.N35
|
COCc1cc[nH]c1C(=O)NCCC1(O)CN(C(=O)C[C@H](C)[C@H](C)C(C)C)C1
|
COCccc[nH]c5C=O)NCCCO)CNC=O)C[C@H]C)[C@H]C)CC)C))))))C4
|
[C][O][C][C][C][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C@H1][Branch1][C][C][C][Branch1][C][C][C][C][Ring1][#C]
|
C3(=O)C[C@H](C)[C@H](C)C(C)C.c18cc[nH]c16.C17(O)CN3C1.C26=O.C5C7.CO4.C48.N25
|
CC(C)(C)[C@H](C#N)C(=O)N1CC2=C(CN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1
|
CCC)C)[C@H]C#N))C=O)NCC=CCNC=O)[C@H]CCcccccc6C%10)))))))))))C5)))C5
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][O][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][Ring1][P][C][Ring2][Ring1][Ring2]
|
[C@H]17CCc2ccccc2C1.CC(C)(C)[C@H](C#N)C5=O.N15CC2=C(C1)CN6C2.C67=O
|
CC(C)(O)[C@H](F)C(=O)NC[C@@H]1C=CCN1C(=O)c1ccn2nccc2c1
|
CCC)O)[C@H]F)C=O)NC[C@@H]C=CCN5C=O)cccnnccc5c9
|
[C][C][Branch1][C][C][Branch1][C][O][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C@@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][N][N][=C][C][=C][Ring1][Branch1][C][=Ring1][=Branch2]
|
c16ccn2nccc2c1.CC(C)(O)[C@H](F)C3=O.[C@@H]17C=CCN14.C46=O.N35.C57
|
C#CCCCCCC(=O)NC[C@@H]1CCC2(CO1)CC(NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2
|
C#CCCCCCC=O)NC[C@@H]CCCCO6))CCNC=O)[C@@H]C[C@H]3[N+]=O)[O-])))))))C4
|
[C][#C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][Branch1][Branch1][C][O][Ring1][=Branch1][C][C][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][N+1][=Branch1][C][=O][O-1][C][Ring1][#C]
|
[C@@H]18CCC2(CO1)CC6C2.C#CCCCCCC3=O.[C@@H]17C[C@H]1[N+](=O)[O-].C47=O.N35.C58.N46
|
NC(=O)N[C@H](CO)C(=O)N1CCOC[C@H]1CC(=O)N1CCc2n[nH]cc2C1
|
NC=O)N[C@H]CO))C=O)NCCOC[C@H]6CC=O)NCCcn[nH]cc5C9
|
[N][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C][O][C][C@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][Ring1][=Branch2]
|
N15CCc2n[nH]cc2C1.N14CCOC[C@H]17.[C@@H]6(CO)C4=O.C7C5=O.NC3=O.N36
|
COc1ccc2c(c1)OC[C@H](C(=O)N[C@@]1(CO)CCCS(=O)(=O)C1)C2
|
COcccccc6)OC[C@H]C=O)N[C@@]CO))CCCS=O)=O)C6))))))))C6
|
[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C@H1][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C@@][Branch1][Ring1][C][O][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch2][C][Ring2][Ring1][Ring2]
|
c14ccc2c(c1)OC[C@H]6C2.[C@]157CCCS(=O)(=O)C1.C36=O.CO4.N35.C7O
|
Cc1cc(C(=O)NCc2ocnc2C(=O)N(C)C23CC(C2)C3)ccc1F
|
CcccC=O)NCcocnc5C=O)NC)CCCC4)C4))))))))))))))ccc6F
|
[C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][Ring1][Branch1][=C][C][=C][Ring2][Ring1][Branch2][F]
|
Cc1cc9ccc1F.c1%10ocnc18.C127CC(C1)C2.C49=O.C58=O.N57C.N46.C6%10
|
CO[C@@H]1C[C@H]2CC[C@H]1C[C@@H]2C(=O)N1CCN(C(=O)c2cc(C(F)F)ccn2)CC1
|
CO[C@@H]C[C@H]CC[C@H]6C[C@@H]6C=O)NCCNC=O)cccCF)F))ccn6)))))))CC6
|
[C][O][C@@H1][C][C@H1][C][C][C@H1][Ring1][=Branch1][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=C][C][=N][Ring1][=Branch2][C][C][Ring1][P]
|
[C@@H]15C[C@H]2CC[C@H]1C[C@@H]27.N13CCN4CC1.c16cc8ccn1.C37=O.C46=O.C8(F)F.CO5
|
Cc1ccc2oc(C(=O)N[C@@H](C)CCCNC(=O)C[C@H](C)F)c(C)c2c1
|
CccccocC=O)N[C@@H]C)CCCNC=O)C[C@H]C)F)))))))))))cC)c5c9
|
[C][C][=C][C][=C][O][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][F][=C][Branch1][C][C][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][=Branch2]
|
Cc1ccc2oc7c(C)c2c1.[C@H]5(C)CCC6.C4(=O)C[C@H](C)F.C37=O.N35.N46
|
C/C=C(\C)C(=O)N[C@H](CCCNC(=O)[C@@](C)(O)C(C)C)c1ccccc1
|
C/C=C\C)C=O)N[C@H]CCCNC=O)[C@@]C)O)CC)C))))))))cccccc6
|
[C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch1][C][O][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C3(=O)[C@@](C)(O)C(C)C.[C@H]47CCC5.c17ccccc1.C=6(C)C2=O.CC=6.N24.N35
|
CCOc1cc(F)cc(C(=O)N2CC3(NC(=O)c4ncn(C)n4)CC2C3)c1
|
CCOcccF)ccC=O)NCCNC=O)cncnC)n5)))))))CC5C4)))))))c6
|
[C][C][O][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][Branch1][S][N][C][=Branch1][C][=O][C][N][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][C][Ring1][=C][C][Ring1][=N][=C][Ring2][Ring1][Branch2]
|
c18cc%11cc(F)c1.N15CC29CC1C2.c1%10ncn(C)n1.C5%11=O.C6%10=O.CC7.O78.N69
|
NC(=O)N[C@@H](CO)C(=O)NC[C@H]1C[C@@H](C(=O)N[C@H]2C[C@@H]3C[C@@H]3C2)C1
|
NC=O)N[C@@H]CO))C=O)NC[C@H]C[C@@H]C=O)N[C@H]C[C@@H]C[C@@H]3C6))))))))C4
|
[N][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C@H1][C][C@@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][Ring1][=N]
|
[C@H]7(CO)C5=O.[C@H]19C[C@@H]2C[C@@H]2C1.[C@H]1%11C[C@@H]%10C1.NC4=O.C6%10=O.N47.N58.C8%11.N69
|
CCO[C@H]1CC[C@@H]1C(=O)NC[C@H](NC(=O)c1cc(C)ns1)C12CCC(CC1)C2
|
CCO[C@H]CC[C@@H]4C=O)NC[C@H]NC=O)cccC)ns5)))))))CCCCCC6))C5
|
[C][C][O][C@H1][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][S][Ring1][=Branch1][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1]
|
C12%11CCC(CC1)C2.c19cc(C)ns1.[C@H]16CC[C@@H]1%10.C7[C@H]8%11.C3%10=O.C49=O.CC5.O56.N37.N48
|
Cc1ccc(C(=O)N[C@H]2[C@@H]3CN(C(=O)c4ccc(Br)cc4C#N)C[C@@H]32)nn1
|
CccccC=O)N[C@H][C@@H]CNC=O)ccccBr)cc6C#N)))))))))C[C@@H]56))))))))nn6
|
[C][C][=C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][#N][C][C@@H1][Ring1][S][Ring1][P][N][=N][Ring2][Ring1][#Branch2]
|
c19ccc(Br)cc1C#N.Cc1ccc8nn1.[C@@H]17[C@H]2CN6C[C@@H]12.C58=O.C69=O.N57
|
CC(C)(CNC(=O)c1ccc(-c2ccccc2)c(F)c1)NC(=O)c1ccncn1
|
CCC)CNC=O)cccc-cccccc6))))))cF)c6)))))))))NC=O)cccncn6
|
[C][C][Branch1][C][C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][=C][Ring1][=N][N][C][=Branch1][C][=O][C][=C][C][=N][C][=N][Ring1][=Branch1]
|
c18ccc9c(F)c1.c19ccccc1.c17ccncn1.CC5(C)C6.C38=O.C47=O.N36.N45
|
CCc1nc2ccccn2c1C(=O)NC[C@H]1C[C@@](F)(CNC(=O)C2(C)CSC2)C1
|
CCcncccccn6c9C=O)NC[C@H]C[C@@]F)CNC=O)CC)CSC4)))))))C4
|
[C][C][C][N][=C][C][=C][C][=C][N][Ring1][=Branch1][C][=Ring1][=Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C@@][Branch1][C][F][Branch1][S][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][S][C][Ring1][Branch1][C][Ring1][=C]
|
c19nc2ccccn2c17.[C@H]1%10C[C@]%11(F)C1.C18(C)CSC1.C37=O.C48=O.CC9.N35.C5%10.C6%11.N46
|
Cc1ccoc1C(=O)N[C@H]1C[C@H](F)CN(C(=O)CNC(=O)c2ccc(F)cc2)C1
|
Ccccoc5C=O)N[C@H]C[C@H]F)CNC=O)CNC=O)ccccF)cc6))))))))))C6
|
[C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][C][F][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring1][Ring2]
|
[C@H]17C[C@H](F)CN4C1.c19ccc(F)cc1.Cc1ccoc18.C4(=O)C6.C38=O.C59=O.N37.N56
|
O=C(NC1CC1)C(=O)N1CC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c(Cl)c3)C[C@@H]21
|
O=CNCCC3))))C=O)NCC[C@@H]CNC=O)cccCl)cF)cCl)c6)))))))C[C@@H]58
|
[O][=C][Branch1][#Branch1][N][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][C@@H1][Ring1][S][Ring2][Ring1][Ring1]
|
N15CC[C@@H]2CN6C[C@@H]21.c18cc(Cl)c(F)c(Cl)c1.O=C4C5=O.C17CC1.C68=O.N47
|
COCCn1cccc(NC(=O)C=Cc2cncc(C)c2)c1=O
|
COCCnccccNC=O)C=CccnccC)c6))))))))))c6=O
|
[C][O][C][C][N][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Ring2][Ring1][C][=O]
|
n17cccc5c1=O.C=6c1cncc(C)c1.C3(=O)C=6.C4C7.CO4.N35
|
CCCC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=O)C=C(C)Cc1ccccc1OC)C2
|
CCCC=O)NC[C@H]CC[C@H]6[C@@H]CNC=O)C=CC)Ccccccc6OC))))))))))))))C6
|
[C][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Ring1][=Branch1][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][=Branch1]
|
N13C[C@H]2CC[C@H]1[C@@H]8C2.c19ccccc15.CCCC3=O.C4(=O)C=7.C=7(C)C9.C68.N46.O5C
|
CCCC[C@H](CC)CCC(=O)NCCc1ccc(C(=O)N(C)C)cc1
|
CCCC[C@H]CC))CCC=O)NCCccccC=O)NC)C)))cc6
|
[C][C][C][C][C@H1][Branch1][Ring1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][Branch1][#Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][Ring1][O]
|
CCCC[C@H](CC)CCC2=O.c16ccc5cc1.C4C6.C35=O.N3(C)C.N24
|
CCC(C#N)(CC)C(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)[C@@H](C)CC(C)C)C2
|
CCCC#N))CC))C=O)N[C@H]CC[C@H]5CCNC)C=O)[C@@H]C)CCC)C))))))C7
|
[C][C][C][Branch1][Ring1][C][#N][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C][C][Branch2][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][Branch1][C][C][C][C][Ring1][P]
|
CCC(C#N)(CC)C3=O.N13[C@H]2CC[C@H]1CC5C2.C4(=O)[C@@H](C)CC(C)C.N45C
|
CN1CC[C@H](CC(=O)NC2C(C)(C)C(NC(=O)CCNC(=O)C=CCl)C2(C)C)C1
|
CNCC[C@H]CC=O)NCCC)C)CNC=O)CCNC=O)C=CCl)))))))))C4C)C))))))))C5
|
[C][N][C][C][C@H1][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][=C][Cl][C][Ring1][P][Branch1][C][C][C][C][Ring2][Ring1][N]
|
C17C(C)(C)C8C1(C)C.CN1CC[C@H]9C1.C4(=O)CC6.C5(=O)C=CCl.C9C3=O.N37.N48.N56
|
C[C@H](O)C(=O)N[C@H]1CCOC[C@H]1NC(=O)CCc1nc(-c2ccccc2)no1
|
C[C@H]O)C=O)N[C@H]CCOC[C@H]6NC=O)CCcnc-cccccc6))))))no5
|
[C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][O][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][O][Ring1][O]
|
[C@H]15CCOC[C@H]16.c17nc8no1.c18ccccc1.C[C@H](O)C3=O.C4(=O)CC7.N35.N46
|
CC/C=C(\C)C(=O)NCC12COC(CNC(=O)[C@H]3CCc4ccccc4C3)(C1)C2
|
CC/C=C\C)C=O)NCCCOCCNC=O)[C@H]CCcccccc6C%10)))))))))))))C5)C5
|
[C][C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C][C][C][O][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][Branch1][Branch1][C][Ring2][Ring1][Ring1][C][Ring2][Ring1][Ring2]
|
[C@H]19CCc2ccccc2C1.C12%12COC%11(C1)C2.C=%10(C)C5=O.CCC=%10.C69=O.N57.C7%12.C8%11.N68
|
CO[C@@H](C(=O)N1C[C@H]2CCC[C@@]2(NC(=O)c2cc(C)c(C)s2)C1)C1CC1
|
CO[C@@H]C=O)NC[C@H]CCC[C@@]5NC=O)cccC)cC)s5)))))))C8)))))))))CCC3
|
[C][O][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@][Ring1][Branch1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][S][Ring1][#Branch1][C][Ring2][Ring1][C][C][C][C][Ring1][Ring1]
|
N13C[C@H]2CCC[C@@]26C1.c17cc(C)c(C)s1.[C@@H]58C3=O.C47=O.C18CC1.CO5.N46
|
COc1ncc(C(=O)N2Cc3n[nH]cc3[C@@H]2C(=O)NC[C@H]2CC23CCC3)s1
|
COcnccC=O)NCcn[nH]cc5[C@@H]8C=O)NC[C@H]CC3CCC4))))))))))))))))))s5
|
[C][O][C][=N][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][=N][NH1][C][=C][Ring1][Branch1][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C][Ring1][Ring1][C][C][C][Ring1][Ring2][S][Ring2][Ring1][=Branch2]
|
N14Cc2n[nH]cc2[C@@H]1C5=O.c16ncc8s1.[C@H]19CC12CCC2.C48=O.CO6.N57.C79
|
Cc1c(C(=O)NC[C@@H]2C[C@@H](C)N(C(=O)c3ncc(Br)cc3F)C2)nnn1C
|
CccC=O)NC[C@@H]C[C@@H]C)NC=O)cnccBr)cc6F))))))))C5))))))))nnn5C
|
[C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][F][C][Ring1][S][N][=N][N][Ring2][Ring1][=Branch2][C]
|
c18ncc(Br)cc1F.Cc1c7nnn1C.[C@@H]19C[C@@H](C)N5C1.C47=O.C58=O.N46.C69
|
CCOC(=O)[C@@H](F)C(=O)N1CCOC[C@@H](NC(=O)c2ccc3c(c2)CC3)C1
|
CCOC=O)[C@@H]F)C=O)NCCOC[C@@H]NC=O)cccccc6)CC4)))))))))C7
|
[C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Ring1][Branch1][C][Ring2][Ring1][C]
|
N15CCOC[C@@H]8C1.c19ccc2c(c1)CC2.C4(=O)[C@@H](F)C5=O.C69=O.CC7.O47.N68
|
COC(=O)N1C[C@H]2C=C[C@H]1[C@H](C(=O)NCCCN(C)C(=O)c1cc(C)sc1C)C2
|
COC=O)NC[C@H]C=C[C@H]6[C@H]C=O)NCCCNC)C=O)cccC)sc5C)))))))))))))C6
|
[C][O][C][=Branch1][C][=O][N][C][C@H1][C][=C][C@H1][Ring1][=Branch1][C@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][C][Ring2][Ring1][#Branch1]
|
N14C[C@H]2C=C[C@H]1[C@H]9C2.c1%10cc(C)sc1C.C7CC8.C34=O.C59=O.N68C.C6%10=O.CO3.N57
|
O=C(NCC(F)(F)C(F)F)[C@H]1CN(C(=O)C2(CF)CC2)C[C@@H]1C1CC1
|
O=CNCCF)F)CF)F)))))[C@H]CNC=O)CCF))CC3))))C[C@@H]5CCC3
|
[O][=C][Branch1][#C][N][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][C][Ring1][Branch1][C][C@@H1][Ring1][N][C][C][C][Ring1][Ring1]
|
[C@H]16CN4C[C@@H]1C1CC1.C5C(F)(F)C(F)F.C178CC1.O=C36.C47=O.N35.C8F
|
CC1(C)CN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@@H](CNC(=O)Cc2cccs2)CO1
|
CCC)CNC=O)[C@@H]CCcnc[nH]c5C9))))))))))[C@@H]CNC=O)Cccccs5)))))))))CO6
|
[C][C][Branch1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C][C][C][N][=C][NH1][C][=Ring1][Branch1][C][Ring1][=Branch2][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][S][Ring1][Branch1][C][O][Ring2][Ring1][N]
|
CC1(C)CN4[C@@H]8CO1.[C@@H]17CCc2nc[nH]c2C1.c19cccs1.C5(=O)C9.C47=O.C68.N56
|
C#CCCCC(=O)N1CC[C@@H]1C(=O)Nc1ccc(OC(F)(F)F)cc1F
|
C#CCCCC=O)NCC[C@@H]4C=O)NccccOCF)F)F)))cc6F
|
[C][#C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][F]
|
c15ccc4cc1F.C#CCCCC2=O.N12CC[C@@H]16.O4C(F)(F)F.C36=O.N35
|
CN=c1cc(C(=O)N2CC[C@@H](C(C)(C)C(=O)NCC[C@H]3CC=CCC3)C2)cc[nH]1
|
CN=cccC=O)NCC[C@@H]CC)C)C=O)NCC[C@H]CC=CCC6)))))))))))C5))))))cc[nH]6
|
[C][N][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][#Branch1][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][=C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C][=C][NH1][Ring2][Ring1][O]
|
CN=c1cc7cc[nH]1.N14CC[C@@H]8C1.C8(C)(C)C5=O.[C@H]19CC=CCC1.C47=O.C6C9.N56
|
COCC(=O)NCC[C@]1(O)CCCN(C(=O)[C@H](CC(C)C)C(C)C)C1
|
COCC=O)NCC[C@]O)CCCNC=O)[C@H]CCC)C)))CC)C))))C6
|
[C][O][C][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][O][C][C][C][N][Branch2][Ring1][Ring1][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@@]16(O)CCCN3C1.C4C2=O.C5C6.CO4.N25
|
O=C(NC(CO)(CO)CO)[C@H]1[C@@H]2CN(C(=O)c3ccc4cccc(F)c4n3)C[C@@H]21
|
O=CNCCO))CO))CO))))[C@H][C@@H]CNC=O)ccccccccF)c6n%10)))))))))))C[C@@H]56
|
[O][=C][Branch1][=N][N][C][Branch1][Ring1][C][O][Branch1][Ring1][C][O][C][O][C@H1][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Branch1][C][F][C][Ring1][#Branch1][=N][Ring1][O][C][C@@H1][Ring2][Ring1][C][Ring2][Ring1][Ring1]
|
c18ccc2cccc(F)c2n1.C7(CO)(CO)CO.[C@@H]19[C@H]2CN6C[C@@H]12.O=C59.C68=O.N57
|
N=c1[nH][nH]c(C(=O)N2CC(CO)(NC(=O)c3cnco3)C2)c1-c1ccccc1
|
N=c[nH][nH]cC=O)NCCCO))NC=O)ccnco5)))))))C4)))))c5-cccccc6
|
[N][=C][NH1][NH1][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][O][Branch1][=N][N][C][=Branch1][C][=O][C][=C][N][=C][O][Ring1][Branch1][C][Ring1][=C][=C][Ring2][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
N=c1[nH][nH]c7c1%10.N14CC69C1.c1%10ccccc1.c18cnco1.C47=O.C58=O.C9O.N56
|
CCN(CC)c1ccc(C(=O)N(C)[C@H]2CN(C(=O)C=C(Cl)Cl)CC23CC3)cn1
|
CCNCC))ccccC=O)NC)[C@H]CNC=O)C=CCl)Cl))))CC5CC3)))))))))cn6
|
[C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][N][Branch1][O][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][Cl][C][C][Ring1][O][C][C][Ring1][Ring1][C][=N][Ring2][Ring1][#Branch1]
|
[C@H]19CN5CC12CC2.c18ccc%10cn1.C5(=O)C=C(Cl)Cl.N678.C4%10=O.N49C.CC6.C7C
|
C[C@@H](CNC(=O)[C@H]1COC(=O)C1)NC(=O)c1ccc(F)c(C(C)(C)F)c1
|
C[C@@H]CNC=O)[C@H]COC=O)C5))))))))NC=O)ccccF)cCC)C)F))c6
|
[C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][F][=C][Ring1][O]
|
c17ccc(F)c8c1.[C@H]16COC(=O)C1.C[C@H]4C5.C8(C)(C)F.C26=O.C37=O.N25.N34
|
O=C(N1C[C@@H]2[C@H](C1)[C@H]1CC[C@H]2O1)C1(c2cc(C(F)(F)F)ccc2Cl)CC1
|
O=CNC[C@@H][C@H]C5)[C@H]CC[C@H]6O5)))))))))CcccCF)F)F))ccc6Cl)))))))CC3
|
[O][=C][Branch2][Ring1][Ring1][N][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C@H1][C][C][C@H1][Ring1][#Branch1][O][Ring1][Branch1][C][Branch2][Ring1][Ring2][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][Cl][C][C][Ring1][=C]
|
N13C[C@@H]2[C@H](C1)[C@H]1CC[C@H]2O1.c16cc5ccc1Cl.C146CC1.C5(F)(F)F.O=C34
|
O=C(C=Cc1cocn1)N[C@@H]1C[C@@H](O)CN(C(=O)C2CC(Cl)(Cl)C2)C1
|
O=CC=Cccocn5)))))))N[C@@H]C[C@@H]O)CNC=O)CCCCl)Cl)C4)))))C6
|
[O][=C][Branch1][#Branch2][C][=C][C][=C][O][C][=N][Ring1][Branch1][N][C@@H1][C][C@@H1][Branch1][C][O][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][Branch1][C][Cl][Branch1][C][Cl][C][Ring1][=Branch1][C][Ring1][#C]
|
[C@@H]15C[C@@H](O)CN4C1.C=7c1cocn1.C16CC(Cl)(Cl)C1.O=C3C=7.C46=O.N35
|
CC1(CN[C@H](c2cccn2C2CC2)c2nnnn2C2CC2)CC(C(F)(F)F)C1
|
CCCN[C@H]ccccn5CCC3))))))))cnnnn5CCC3)))))))))))CCCF)F)F))C4
|
[C][C][Branch2][Ring1][=C][C][N][C@H1][Branch1][=N][C][=C][C][=C][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][=N][N][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][O]
|
CC17CC8C1.c15cccn19.c16nnnn1%10.C8(F)(F)F.[C@@H]456.C19CC1.C1%10CC1.C37.N34
|
CCC[C@H]1CN(C(=O)[C@@H]2CC(C)=NO2)CCN1C(=O)CN1CCc2sccc2C1
|
CCC[C@H]CNC=O)[C@@H]CCC)=NO5))))))CCN6C=O)CNCCcsccc5C9
|
[C][C][C][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][C][C][Branch1][C][C][=N][O][Ring1][=Branch1][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][N][C][C][C][S][C][=C][C][=Ring1][Branch1][C][Ring1][=Branch2]
|
N15CCc2sccc2C1.[C@H]17CN3CCN14.[C@@H]16CC(C)=NO1.C4(=O)C5.CCC7.C36=O
|
CC(C)N1CC(C(=O)N[C@H]2COCCN(C(=O)CCc3ccn(C)n3)C2)C1
|
CCC)NCCC=O)N[C@H]COCCNC=O)CCcccnC)n5))))))))C7)))))))))C4
|
[C][C][Branch1][C][C][N][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][C][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][C][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][Ring1][P][C][Ring2][Ring1][Branch2]
|
[C@H]17COCCN5C1.c19ccn(C)n1.N16CC8C1.C5(=O)CC9.CC6C.C48=O.N47
|
CCC[C@@H](C)CC(=O)N1CC(CNC(=O)c2c[nH]nc2F)(OC)C1
|
CCC[C@@H]C)CC=O)NCCCNC=O)cc[nH]nc5F)))))))))OC))C4
|
[C][C][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][F][Branch1][Ring1][O][C][C][Ring1][S]
|
CCC[C@@H](C)CC3=O.N13CC58C1.c17c[nH]nc1F.C47=O.C68.N46.O5C
|
COc1ccc(-n2nc(-c3ccccn3)nc2-c2cc(C)c(C)n(C)c2=O)cc1
|
COcccc-nnc-cccccn6))))))nc5-cccC)cC)nC)c6=O))))))))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring2][Ring2][N][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][N][=C][Ring1][O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][N][Branch1][C][C][C][Ring1][=Branch2][=O][C][=C][Ring2][Ring1][O]
|
c17cc(C)c(C)n(C)c1=O.c14ccc5cc1.n15nc6nc17.c16ccccn1.CO4
|
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