SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
COCc1ccoc1C(=O)N[C@@H]1CCOC[C@H]1C(=O)NCC(C)(C)O
|
COCcccoc5C=O)N[C@@H]CCOC[C@H]6C=O)NCCC)C)O
|
[C][O][C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][O]
|
[C@@H]16CCOC[C@H]18.c19ccoc17.C5C(C)(C)O.C27=O.C38=O.CO4.C49.N26.N35
|
CCn1cnnc1CN(C)Cc1cn(Cc2c(F)cncc2Br)nn1
|
CCncnnc5CNC)CccnCccF)cncc6Br))))))))nn5
|
[C][C][N][C][=N][N][=C][Ring1][Branch1][C][N][Branch1][C][C][C][C][=C][N][Branch1][=C][C][C][=C][Branch1][C][F][C][=N][C][=C][Ring1][#Branch1][Br][N][=N][Ring1][=C]
|
c19c(F)cncc1Br.n15cnnc17.c18cn6nn1.N34C.CC5.C37.C48.C69
|
CC(C(=O)NC[C@@H]1CN(C)CCN1C(=O)C[C@H]1CCCC1(F)F)=C1CCCC1
|
CCC=O)NC[C@@H]CNC)CCN6C=O)C[C@H]CCCC5F)F)))))))))))))))))=CCCCC5
|
[C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C@H1][C][C][C][C][Ring1][Branch1][Branch1][C][F][F][=C][C][C][C][C][Ring1][Branch1]
|
[C@@H]16CN(C)CCN13.[C@H]17CCCC1(F)F.CC=5C2=O.C1=5CCCC1.C3(=O)C7.N24.C46
|
O=C(NC1CC(F)(F)C1)[C@H](c1ncc(C(F)(F)F)[nH]1)N1CCc2ncncc2C1
|
O=CNCCCF)F)C4)))))[C@H]cnccCF)F)F))[nH]5)))))NCCcncncc6C%10
|
[O][=C][Branch1][=C][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C@H1][Branch2][Ring1][C][C][=N][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][NH1][Ring1][=Branch2][N][C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][C][Ring1][#Branch2]
|
N14CCc2ncncc2C1.C15CC(F)(F)C1.c16ncc7[nH]1.O=C3[C@@H]46.C7(F)(F)F.N35
|
CN(CC(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)Cn1cc(CO)nn1)C1CC1
|
CNCC=O)N[C@@H]Ccccccc6[C@H]9NC=O)CnccCO))nn5))))))))))))))))))))CCC3
|
[C][N][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Ring1][=Branch2][N][C][=Branch1][C][=O][C][N][C][=C][Branch1][Ring1][C][O][N][=N][Ring1][#Branch1][C][C][C][Ring1][Ring1]
|
[C@@H]17Cc2ccccc2[C@H]1N4.n18cc9nn1.C5C3=O.C4(=O)C8.CN56.C16CC1.N37.C9O
|
O=C(CNC(=O)N1CCCC1)NCCOCCNc1ccc([N+](=O)[O-])cc1Cl
|
O=CCNC=O)NCCCC5))))))))NCCOCCNcccc[N+]=O)[O-]))cc6Cl
|
[O][=C][Branch1][=C][C][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][N][C][C][O][C][C][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][Cl]
|
c1%10ccc([N+](=O)[O-])cc1Cl.N14CCCC1.O=C2C7.C34=O.C8C5.C6C9.N37.N28.O56.N9%10
|
C[C@H](CNC(=O)CC1CC(F)C1)N(C)C(=O)c1nn(C)cc1I
|
C[C@H]CNC=O)CCCCF)C4))))))))NC)C=O)cnnC)cc5I
|
[C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][C][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][I]
|
c16nn(C)cc1I.C17CC(F)C1.C[C@@H]4C5.C2(=O)C7.N34C.C36=O.N25
|
N=c1[nH]c2cc(C(=O)NCC3(NC(=O)CCC(F)F)CCCC3)ccc2s1
|
N=c[nH]cccC=O)NCCNC=O)CCCF)F))))))CCCC5))))))))ccc6s9
|
[N][=C][NH1][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][Branch1][=N][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][F][C][C][C][C][Ring1][=N][=C][C][=C][Ring2][Ring1][#Branch1][S][Ring2][Ring1][#Branch2]
|
N=c1[nH]c2cc8ccc2s1.C5(=O)CCC(F)F.C179CCCC1.C48=O.N46.C69.N57
|
O=C(N[C@H]1C[C@H](Cc2ccccc2)C1)c1ccccc1-c1cc[nH]n1
|
O=CN[C@H]C[C@H]Ccccccc6)))))))C4)))))cccccc6-ccc[nH]n5
|
[O][=C][Branch2][Ring1][Ring1][N][C@H1][C][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][NH1][N][=Ring1][Branch1]
|
c15ccccc18.c17ccccc1.[C@H]14C[C@H]6C1.c18cc[nH]n1.O=C35.N34.C67
|
CCOC(=O)CC[C@@H](C)N1CCC(C(=O)N[C@@H](C)c2nc(CC(C)C)no2)CC1
|
CCOC=O)CC[C@@H]C)NCCCC=O)N[C@@H]C)cncCCC)C)))no5))))))))CC6
|
[C][C][O][C][=Branch1][C][=O][C][C][C@@H1][Branch1][C][C][N][C][C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=N][C][Branch1][#Branch1][C][C][Branch1][C][C][C][=N][O][Ring1][=Branch2][C][C][Ring2][Ring1][Ring2]
|
C3(=O)CC[C@H]6C.N16CCC8CC1.c19nc%10no1.C%10C(C)C.C48=O.[C@@H]79C.CC5.O35.N47
|
CC(=O)N[C@H](C)C(=O)N1CC2(C[C@H]2C(=O)Nc2cc(I)cc3[nH]ccc23)C1
|
CC=O)N[C@H]C)C=O)NCCC[C@H]3C=O)NcccI)cc[nH]ccc95)))))))))))))C4
|
[C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch2][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][I][=C][C][NH1][C][=C][C][Ring1][#Branch2][=Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
c18cc(I)cc2[nH]ccc12.N15CC2(C[C@H]29)C1.[C@@H]7(C)C5=O.CC4=O.C69=O.N47.N68
|
C=C1CC(CNC(=O)c2cnc(Cl)s2)(C(=O)N2CCn3ncc(C)c3C2)C1
|
C=CCCCNC=O)ccncCl)s5))))))))C=O)NCCnnccC)c5C9))))))))))C4
|
[C][=C][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Cl][S][Ring1][=Branch1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][N][N][=C][C][Branch1][C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][Ring2][Ring1][#Branch2]
|
N15CCn2ncc(C)c2C1.C=C1CC89C1.c17cnc(Cl)s1.C47=O.C58=O.C69.N46
|
CCCC=C(CC)C(=O)N1CC[C@@H](C2CC2)[C@H]1C(=O)N1CCCCO1
|
CCCC=CCC))C=O)NCC[C@@H]CCC3)))[C@H]5C=O)NCCCCO6
|
[C][C][C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][C][O][Ring1][=Branch1]
|
N13CC[C@@H](C2CC2)[C@H]14.C4(=O)N1CCCCO1.C=5(CC)C3=O.CCCC=5
|
Cc1cccc2[nH]c(C(=O)N(C)C[C@@H]3CCCN(c4ncc(Br)cn4)C3)cc12
|
Cccccc[nH]cC=O)NC)C[C@@H]CCCNcnccBr)cn6))))))C6)))))))))cc95
|
[C][C][=C][C][=C][C][NH1][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][Br][C][=N][Ring1][#Branch1][C][Ring1][=N][=C][C][Ring2][Ring1][O][=Ring2][Ring1][#Branch1]
|
Cc1cccc2[nH]c8cc12.[C@@H]19CCCN7C1.c17ncc(Br)cn1.C58=O.N56C.C69
|
CCC(CC(C)(O)CC)NCCCCN(C)C1CC1
|
CCCCCC)O)CC))))NCCCCNC)CCC3
|
[C][C][C][Branch1][O][C][C][Branch1][C][C][Branch1][C][O][C][C][N][C][C][C][C][N][Branch1][C][C][C][C][C][Ring1][Ring1]
|
CCC2CC(C)(O)CC.C3CCC4.N45C.C15CC1.N23
|
COCCCC(=O)NCCn1cc(C(=O)N2Cc3cccc(C)c3C2)nn1
|
COCCCC=O)NCCnccC=O)NCcccccC)c6C9))))))))))nn5
|
[C][O][C][C][C][C][=Branch1][C][=O][N][C][C][N][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Ring1][#Branch2][N][=N][Ring1][P]
|
N15Cc2cccc(C)c2C1.C6CCC4=O.n19cc8nn1.C7C9.C58=O.CO6.N47
|
CC(C)c1oncc1C(=O)NC[C@@H]1CN(C(=O)c2csc(CO)n2)[C@H]2C[C@H]12
|
CCC)concc5C=O)NC[C@@H]CNC=O)ccscCO))n5))))))[C@H]C[C@H]63
|
[C][C][Branch1][C][C][C][O][N][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][S][C][Branch1][Ring1][C][O][=N][Ring1][#Branch1][C@H1][C][C@H1][Ring1][#C][Ring1][Ring1]
|
[C@@H]1%10CN4[C@H]2C[C@H]12.c18oncc17.c16csc9n1.CC8C.C37=O.C46=O.N35.C5%10.C9O
|
O=C(CCc1ccco1)N[C@H]1CC[C@@H]1C(=O)N[C@@H]1CCCNC1=O
|
O=CCCcccco5)))))))N[C@H]CC[C@@H]4C=O)N[C@@H]CCCNC6=O
|
[O][=C][Branch1][#Branch2][C][C][C][=C][C][=C][O][Ring1][Branch1][N][C@H1][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][C][Ring1][=Branch1][=O]
|
[C@@H]15CCCNC1=O.O=C2CC7.c17ccco1.[C@H]14CC[C@@H]16.C36=O.N24.N35
|
CC1(C)OCCN(C(=O)N[C@H]2CC(C)(C)C23CC3)[C@H]1CO
|
CCC)OCCNC=O)N[C@H]CCC)C)C4CC3))))))))[C@H]6CO
|
[C][C][Branch1][C][C][O][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][C][C][Ring1][Ring1][C@H1][Ring2][Ring1][C][C][O]
|
CC1(C)OCCN4[C@H]17.[C@H]16CC(C)(C)C12CC2.C45=O.N56.C7O
|
Cc1nnn(CC(=O)N2CC=C[C@@]2(C)C(=O)N[C@H](C)C2CCOCC2)n1
|
CcnnnCC=O)NCC=C[C@@]5C)C=O)N[C@H]C)CCCOCC6))))))))))))))))n5
|
[C][C][N][=N][N][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][=C][C@@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][O][C][C][Ring1][=Branch1][N][=Ring2][Ring1][=Branch2]
|
N13CC=C[C@]16C.Cc1nnn7n1.C18CCOCC1.C7C3=O.C46=O.[C@H]58C.N45
|
CCCc1nc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3C(=O)C2=CCOCC2)cs1
|
CCCcncC=O)NCC[C@H]CC[C@@H]C7)N5C=O)C=CCOCC6))))))))))))))))cs5
|
[C][C][C][C][=N][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][O][C][C][Ring1][=Branch1][=C][S][Ring2][Ring1][Branch2]
|
C16C[C@H]2CC[C@@H](C1)N25.C5(=O)C1=CCOCC1.c18nc7cs1.CCC8.C47=O.N46
|
CC1(C)C[C@H]1CC(=O)N[C@@H]1COC2(CCN(C(=O)c3ccsc3Cl)CC2)C1
|
CCC)C[C@H]3CC=O)N[C@@H]COCCCNC=O)cccsc5Cl)))))))CC6)))))C5
|
[C][C][Branch1][C][C][C][C@H1][Ring1][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][O][C][Branch2][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][Cl][C][C][Ring1][=C][C][Ring2][Ring1][C]
|
[C@@H]16COC2(CCN5CC2)C1.c17ccsc1Cl.CC1(C)C[C@H]18.C8C4=O.C57=O.N46
|
CCN(CC)CC(=O)N1CCC[C@@H](NC(=O)c2sc(C)cc2OC(F)F)C1
|
CCNCC))CC=O)NCCC[C@@H]NC=O)cscC)cc5OCF)F))))))))))C6
|
[C][C][N][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][S][C][Branch1][C][C][=C][C][=Ring1][=Branch1][O][C][Branch1][C][F][F][C][Ring2][Ring1][Ring1]
|
N13CCC[C@@H]9C1.c1%10sc(C)cc15.C8C3=O.O5C(F)F.N678.C4%10=O.CC6.C7C.N49
|
COC(=O)[C@H](CC(C)C)n1nnnc1[C@H](NCc1cc(C)oc1C)C1CCC1
|
COC=O)[C@H]CCC)C)))nnnnc5[C@H]NCcccC)oc5C))))))))CCCC4
|
[C][O][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][N][=N][N][=C][Ring1][Branch1][C@H1][Branch1][=C][N][C][C][C][=C][Branch1][C][C][O][C][=Ring1][=Branch1][C][C][C][C][C][Ring1][Ring2]
|
C2(=O)[C@@H]5CC(C)C.c18cc(C)oc1C.n15nnnc16.C17CCC1.[C@H]367.CO2.N34.C48
|
CCCC=CC(=O)N1CCN(C(=O)c2snnc2CC)[C@@H](c2ccncc2)C1
|
CCCC=CC=O)NCCNC=O)csnnc5CC))))))))[C@@H]cccncc6))))))C6
|
[C][C][C][C][=C][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][S][N][=N][C][=Ring1][Branch1][C][C][C@@H1][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Branch1]
|
N13CCN4[C@@H]8C1.c15snnc17.c18ccncc1.CCCC=6.C=6C3=O.C45=O.C7C
|
CC=C(CC)C(=O)NCCC[C@H]1CCCN1C(=O)[C@H]1CCC(=O)[C@@H](C)C1
|
CC=CCC))C=O)NCCC[C@H]CCCN5C=O)[C@H]CCC=O)[C@@H]C)C6
|
[C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Ring1][Branch2]
|
[C@H]15CCC(=O)[C@@H](C)C1.C=6(CC)C2=O.[C@H]17CCCN13.C4CC7.C35=O.CC=6.N24
|
COC1(CNC(=O)[C@@H](n2ccnn2)C(C)(C)C)CN(C(=O)c2csc(O)n2)C1
|
COCCNC=O)[C@@H]nccnn5)))))CC)C)C))))))CNC=O)ccscO)n5))))))C4
|
[C][O][C][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][O][=N][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
C3(=O)[C@@H]8C(C)(C)C.C159CN4C1.c17csc(O)n1.n18ccnn1.C47=O.CO5.C69.N36
|
O=C(Cc1ccnc(Cl)c1F)NCCNC(=O)C[C@H]1CC(c2ccccc2)=NO1
|
O=CCcccncCl)c6F))))))))NCCNC=O)C[C@H]CCcccccc6))))))=NO5
|
[O][=C][Branch1][=C][C][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][N][C][C][N][C][=Branch1][C][=O][C][C@H1][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][O][Ring1][O]
|
[C@H]17CC(c2ccccc2)=NO1.c18ccnc(Cl)c1F.O=C3C8.C4(=O)C7.C5C6.N35.N46
|
CCSCCC(=O)N1CCC[C@@](CC)(NC(=O)[C@H](O)Cc2ccc(OC)cc2)C1
|
CCSCCC=O)NCCC[C@@]CC))NC=O)[C@H]O)CccccOC))cc6))))))))))C6
|
[C][C][S][C][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][Ring1][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][Ring2][Ring1][=Branch1]
|
N13CCC[C@]69C1.c1%10ccc5cc1.C4(=O)[C@H](O)C%10.C8CC3=O.CC7.S78.C9C.N46.O5C
|
C#CCCN(C)CC(=O)NC[C@@](C)(CC)NC(=O)[C@H]1OCCN(C)C1=O
|
C#CCCNC)CC=O)NC[C@@]C)CC))NC=O)[C@H]OCCNC)C6=O
|
[C][#C][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C@H1][O][C][C][N][Branch1][C][C][C][Ring1][#Branch1][=O]
|
[C@H]18OCCN(C)C1=O.C6[C@@]7(C)CC.C#CCC4.C5C2=O.N45C.C38=O.N26.N37
|
COC(=O)C12CC(CC(=O)NC[C@H]3CN(C(=O)C(C)=CC4CC4)C[C@@H]3C)(C1)C2
|
COC=O)CCCCC=O)NC[C@H]CNC=O)CC)=CCCC3))))))C[C@@H]5C))))))))))C4)C4
|
[C][O][C][=Branch1][C][=O][C][C][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][C][C][=C][C][C][C][Ring1][Ring1][C][C@@H1][Ring1][=N][C][Branch1][Branch1][C][Ring2][Ring1][#Branch1][C][Ring2][Ring1][Branch2]
|
[C@H]1%12CN7C[C@@H]1C.C129CC%11(C1)C2.C7(=O)C=%10C.C%11C6=O.C=%10C1CC1.C59=O.CO5.N68.C8%12
|
CCOCC[C@H](NC(=O)c1ncc2ccccn12)C(=O)N[C@H]1[C@H](O)C[C@@H]1O
|
CCOCC[C@H]NC=O)cnccccccn96)))))))))))C=O)N[C@H][C@H]O)C[C@@H]4O
|
[C][C][O][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C@H1][Branch1][C][O][C][C@@H1][Ring1][Branch1][O]
|
c19ncc2ccccn12.C6C[C@H]7C4=O.[C@H]18[C@H](O)C[C@@H]1O.C39=O.CC5.O56.N37.N48
|
CCOC(=O)c1c(NC(=O)c2nc(C)n(C3CC3)c2C)cnn1CC
|
CCOC=O)ccNC=O)cncC)nCCC3)))c5C))))))))cnn5CC
|
[C][C][O][C][=Branch1][C][=O][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][N][=C][Branch1][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=Ring1][=Branch2][C][C][=N][N][Ring2][Ring1][C][C][C]
|
c19nc(C)n%11c1C.c18c7cnn1%10.C48=O.C59=O.C1%11CC1.CC6.O46.N57.C%10C
|
COc1c(C(=O)NC[C@@H](O)CNC(=O)c2cc(C)sc2C)cccc1C(F)F
|
COccC=O)NC[C@@H]O)CNC=O)cccC)sc5C)))))))))))))cccc6CF)F
|
[C][O][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][C][=C][C][=C][Ring2][Ring1][#Branch1][C][Branch1][C][F][F]
|
c15c8cccc1%10.c19cc(C)sc1C.C6[C@@H](O)C7.C38=O.C49=O.C%10(F)F.CO5.N36.N47
|
CC/C=C(\C)C(=O)N[C@H](CO)[C@H](C)NC(=O)[C@H](C(C)C)n1ccnc1
|
CC/C=C\C)C=O)N[C@H]CO))[C@H]C)NC=O)[C@H]CC)C))nccnc5
|
[C][C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=C][N][=C][Ring1][Branch1]
|
C3(=O)[C@@H]7C(C)C.[C@@H]4(CO)[C@@H]5C.C=6(C)C2=O.n17ccnc1.CCC=6.N24.N35
|
CCOC(=O)C1CN(C(=O)C#CCNC(=O)[C@H](F)C(C)(F)F)C1
|
CCOC=O)CCNC=O)C#CCNC=O)[C@H]F)CC)F)F)))))))))C4
|
[C][C][O][C][=Branch1][C][=O][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][#C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][Branch1][C][C][Branch1][C][F][F][C][Ring2][Ring1][C]
|
C4(=O)[C@H](F)C(C)(F)F.C3(=O)C#CC6.C17CN3C1.C27=O.CC5.O25.N46
|
CCOC(=O)c1nc(C(=O)N(C)[C@@H](C)CNC(=O)C23CC(C)(CO2)C3)cs1
|
CCOC=O)cncC=O)NC)[C@@H]C)CNC=O)CCCC)CO5))C4))))))))))cs5
|
[C][C][O][C][=Branch1][C][=O][C][=N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][Branch1][C][O][Ring1][=Branch1][C][Ring1][#Branch1][=C][S][Ring2][Ring1][=Branch1]
|
C12%10CC(C)(CO1)C2.c1%11nc%12cs1.[C@H]8(C)C9.C4%11=O.C5%12=O.N58C.C6%10=O.CC7.O47.N69
|
COc1c(C)cc(Cl)cc1C(=O)NC[C@@H]1CCN(C(=O)CCCC(OC)OC)C1
|
COccC)ccCl)cc6C=O)NC[C@@H]CCNC=O)CCCCOC))OC)))))))C5
|
[C][O][C][=C][Branch1][C][C][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring1][O][C][O][C][C][Ring1][#C]
|
c16c8cc(Cl)cc1C.C3(=O)CCCC45.[C@@H]19CCN3C1.C28=O.CO6.N27.C79.O4C.O5C
|
CC(C)(O)C#CC(=O)N1CCC[C@@](C)(NC(=O)C2C(C)(C)CCCC2(C)C)C1
|
CCC)O)C#CC=O)NCCC[C@@]C)NC=O)CCC)C)CCCC6C)C)))))))))C6
|
[C][C][Branch1][C][C][Branch1][C][O][C][#C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][Ring1][Branch2][Branch1][C][C][C][C][Ring2][Ring1][Ring2]
|
C16C(C)(C)CCCC1(C)C.CC(C)(O)C#CC3=O.N13CCC[C@]5(C)C1.C46=O.N45
|
Cc1c(C(=O)NC[C@H]2CN(C(=O)CC3(O)CCCC3)C[C@H]2C)ccc2n[nH]cc12
|
CccC=O)NC[C@H]CNC=O)CCO)CCCC5)))))))C[C@H]5C)))))))))cccn[nH]cc95
|
[C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][C][C][Ring1][=Branch1][C][C@H1][Ring1][=C][C][C][=C][C][=N][NH1][C][=C][Ring2][Ring1][N][Ring1][Branch1]
|
Cc1c7ccc2n[nH]cc12.[C@H]18CN5C[C@H]1C.C19(O)CCCC1.C5(=O)C9.C47=O.N46.C68
|
C=C[C@@H](C)[C@@H](C)C(=O)NCCOC1CCN(C(=O)c2cn(C)nc2Cl)CC1
|
C=C[C@@H]C)[C@@H]C)C=O)NCCOCCCNC=O)ccnC)nc5Cl)))))))CC6
|
[C][=C][C@@H1][Branch1][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][Cl][C][C][Ring1][#C]
|
C=C[C@@H](C)[C@@H](C)C3=O.C16CCN4CC1.c18cn(C)nc1Cl.C7C5.C48=O.N37.O56
|
COc1ccc2nc(C)cc(C(=O)N[C@H]3C[C@@H](NC(=O)COC(F)F)C3)c2c1
|
COccccncC)ccC=O)N[C@H]C[C@@H]NC=O)COCF)F))))))C4))))))c6c%10
|
[C][O][C][=C][C][=C][N][=C][Branch1][C][C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][O][C][Branch1][C][F][F][C][Ring1][N][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2]
|
c17ccc2nc(C)cc%10c2c1.[C@H]18C[C@@H]9C1.C5(=O)C6.O6C(F)F.C4%10=O.CO7.N48.N59
|
CC(=O)N[C@@]1(c2nc(C)no2)CCN(C(=O)NCC[C@@H]2C[C@H]2C(F)(F)F)C1
|
CC=O)N[C@@]cncC)no5)))))CCNC=O)NCC[C@@H]C[C@H]3CF)F)F)))))))))C5
|
[C][C][=Branch1][C][=O][N][C@@][Branch1][O][C][=N][C][Branch1][C][C][=N][O][Ring1][=Branch1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][#Branch1]
|
[C@]16%10CCN4C1.c1%10nc(C)no1.[C@@H]18C[C@H]19.C9(F)(F)F.CC3=O.C45=O.C7C8.N36.N57
|
Cc1oncc1S(=O)(=O)N1CC(NC(=O)/C=C/c2ccc(Br)cc2Cl)C1
|
Cconcc5S=O)=O)NCCNC=O)/C=C/ccccBr)cc6Cl)))))))))))C4
|
[C][C][O][N][=C][C][=Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Cl][C][Ring1][P]
|
Cc1oncc1S4(=O)=O.C=6c1ccc(Br)cc1Cl.N14CC5C1.C3(=O)C=6.N35
|
Cc1ccn(CC(=O)N[C@@H](C)CNC(=O)[C@@]23CCC[C@@H](CO2)C3)c1
|
CcccnCC=O)N[C@@H]C)CNC=O)[C@@]CCC[C@@H]CO7))C6)))))))))))))c5
|
[C][C][C][=C][N][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@][C][C][C][C@@H1][Branch1][Branch1][C][O][Ring1][#Branch1][C][Ring1][Branch2][C][=Ring2][Ring1][#Branch1]
|
[C@@]128CCC[C@@H](CO1)C2.Cc1ccn9c1.C9C4=O.[C@H]6(C)C7.C58=O.N46.N57
|
CSc1cc(C(=O)NC[C@@H](CC2CC2)C(=O)N2CCC3(CC2)C[C@@H]3CO)co1
|
CScccC=O)NC[C@@H]CCCC3))))C=O)NCCCCC6))C[C@@H]3CO)))))))))))))co5
|
[C][S][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C@@H1][Ring1][Branch1][C][O][=C][O][Ring2][Ring1][#Branch2]
|
N15CCC2(CC1)C[C@@H]29.C6[C@@H](C8)C5=O.c1%10cc7co1.C47=O.C18CC1.CS%10.N46.C9O
|
Cn1cc(C(=O)NC2(C3CN(C(=O)c4ccc([N+](=O)[O-])cc4Cl)C3)CC2)nn1
|
CnccC=O)NCCCNC=O)cccc[N+]=O)[O-]))cc6Cl))))))))C4))))CC3)))))nn5
|
[C][N][C][=C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][Branch2][Ring1][=C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][Cl][C][Ring1][S][C][C][Ring2][Ring1][Ring1][N][=N][Ring2][Ring1][O]
|
c19ccc([N+](=O)[O-])cc1Cl.C17(C2CN6C2)CC1.Cn1cc8nn1.C58=O.C69=O.N57
|
CCC(C)(C)NC(=O)[C@H](c1cccc(F)c1F)N(C)C[C@H]1C[C@H]1C
|
CCCC)C)NC=O)[C@H]cccccF)c6F)))))))NC)C[C@H]C[C@H]3C
|
[C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F][N][Branch1][C][C][C][C@H1][C][C@H1][Ring1][Ring1][C]
|
c17cccc(F)c1F.CCC3(C)C.C2(=O)[C@@H]47.[C@H]16C[C@H]1C.N45C.N23.C56
|
Cc1cccc2c1CC[C@H]2NCc1cn(-c2cnc3cc(Cl)ccc3n2)nn1
|
Ccccccc6CC[C@H]5NCccn-ccncccCl)ccc6n%10))))))))))nn5
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C@H1][Ring1][Branch1][N][C][C][=C][N][Branch2][Ring1][C][C][=C][N][=C][C][=C][Branch1][C][Cl][C][=C][C][Ring1][#Branch1][=N][Ring1][O][N][=N][Ring1][S]
|
Cc1cccc2c1CC[C@H]2N4.c16cnc2cc(Cl)ccc2n1.c15cn6nn1.C45
|
CC(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)C1
|
CCC)NC=O)[C@@H]CCCNS=O)=O)cccCl)ccc6CF)F)F)))))))))C6
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Branch2][Ring1][O][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][Ring2]
|
S5(=O)(=O)c1cc(Cl)ccc17.[C@@H]16CCCN5C1.C7(F)(F)F.CC4C.C36=O.N34
|
CC=CCONC(=O)[C@]1(NC(=O)C23C(=O)C4C[C@@H]2[C@@H]3C4)CCC[C@@H]1C
|
CC=CCONC=O)[C@]NC=O)CC=O)CC[C@@H]5[C@@H]6C5)))))))))CCC[C@@H]5C
|
[C][C][=C][C][O][N][C][=Branch1][C][=O][C@][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][C][C][C@@H1][Ring1][=Branch1][C@@H1][Ring1][#Branch1][C][Ring1][Branch1][C][C][C][C@@H1][Ring1][S][C]
|
C129C(=O)C3C[C@@H]1[C@@H]2C3.[C@]178CCC[C@@H]1C.O6NC8=O.C=%10C6.C59=O.CC=%10.N57
|
Cc1cc(Br)c(O)c(CN[C@H]2CC[C@@H](C(=O)Nc3cc(C(N)=O)nn3C)C2)c1
|
CcccBr)cO)cCN[C@H]CC[C@@H]C=O)NcccCN)=O))nn5C))))))))C5)))))))c6
|
[C][C][=C][C][Branch1][C][Br][=C][Branch1][C][O][C][Branch2][Ring1][P][C][N][C@H1][C][C][C@@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=N][N][Ring1][Branch2][C][C][Ring1][P][=C][Ring2][Ring1][O]
|
Cc1cc%10c(O)c(Br)c1.c16cc8nn1C.[C@H]17CC[C@@H]9C1.C49=O.C8(N)=O.C5%10.N57.N46
|
C=CCN(CCC)C(=O)[C@@]1(CF)CCN(C(=O)c2ccc(C)nc2O)C1
|
C=CCNCCC)))C=O)[C@@]CF))CCNC=O)ccccC)nc6O))))))))C5
|
[C][=C][C][N][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][F][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][O][C][Ring1][P]
|
c18ccc(C)nc1O.[C@]179CCN4C1.C=CC5.N356.C6CC.C37=O.C48=O.C9F
|
Cn1ccnc1CCNC(=O)[C@@]1(CO)CCN(C(=O)c2ccc(O)cc2F)C1
|
Cnccnc5CCNC=O)[C@@]CO))CCNC=O)ccccO)cc6F))))))))C5
|
[C][N][C][=C][N][=C][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][F][C][Ring1][P]
|
c17ccc(O)cc1F.[C@]169CCN4C1.Cn1ccnc18.C8C5.C36=O.C47=O.N35.C9O
|
C#Cc1ccc(CC(=O)N[C@@H](C)[C@@H]2C[C@H]2C(=O)N(CC)OC)cc1
|
C#CccccCC=O)N[C@@H]C)[C@@H]C[C@H]3C=O)NCC))OC)))))))))))cc6
|
[C][#C][C][=C][C][=C][Branch2][Ring1][O][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][O][C][C][=C][Ring2][Ring1][=Branch1]
|
C#Cc1ccc7cc1.C5(=O)N(CC)OC.C7C3=O.[C@@H]16C[C@H]15.[C@@H]46C.N34
|
CC[C@@H](O)[C@H](C)C(=O)N(C)C[C@@H](C)N(C)C(=O)c1csc(-c2cccc(C)n2)n1
|
CC[C@@H]O)[C@H]C)C=O)NC)C[C@@H]C)NC)C=O)ccsc-cccccC)n6))))))n5
|
[C][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][S][C][Branch1][N][C][=C][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][=N][Ring1][N]
|
CC[C@@H](O)[C@H](C)C3=O.c18cccc(C)n1.c17csc8n1.C5[C@H]6C.N35C.N46C.C47=O
|
CCn1ccc(C(=O)N[C@@H](C)CNC(=O)c2cc3c(F)c(F)ccc3[nH]2)n1
|
CCncccC=O)N[C@@H]C)CNC=O)ccccF)cF)ccc6[nH]9)))))))))))))))n5
|
[C][C][N][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][C][=C][Ring1][Branch2][NH1][Ring1][O][=N][Ring2][Ring1][=Branch2]
|
c19cc2c(F)c(F)ccc2[nH]1.n1%10ccc8n1.[C@H]6(C)C7.C48=O.C59=O.CC%10.N46.N57
|
Cc1ccc(CN(C)CC(=O)NC[C@@H]2CCC[C@@H](NC(=O)C3=CCCS3)C2)cc1
|
CccccCNC)CC=O)NC[C@@H]CCC[C@@H]NC=O)C=CCCS5)))))))C6))))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][Ring1][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][C][S][Ring1][Branch1][C][Ring1][=C][C][=C][Ring2][Ring1][N]
|
Cc1ccc%11cc1.[C@@H]1%10CCC[C@@H]9C1.C5(=O)C1=CCCS1.C7C4=O.N67C.C6%11.N48.C8%10.N59
|
CC(C)CS(=O)(=O)CC(=O)N[C@H]1C[C@H](CNC(=O)c2ccc([N+](=O)[O-])s2)C1(C)C
|
CCC)CS=O)=O)CC=O)N[C@H]C[C@H]CNC=O)cccc[N+]=O)[O-]))s5))))))))C4C)C
|
[C][C][Branch1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][S][Ring1][Branch2][C][Ring1][S][Branch1][C][C][C]
|
CC(C)CS(=O)(=O)CC3=O.c17ccc([N+](=O)[O-])s1.[C@H]16C[C@H]8C1(C)C.C47=O.N36.C58.N45
|
COC1CN(C(=O)C2(C)CC(NC(=O)c3ccc(C)o3)C2)C1
|
COCCNC=O)CC)CCNC=O)ccccC)o5)))))))C4)))))C4
|
[C][O][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C][Branch1][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][O][Ring1][=Branch1][C][Ring1][=C][C][Ring2][Ring1][Ring2]
|
C19(C)CC7C1.c18ccc(C)o1.C16CN4C1.C49=O.C58=O.CO6.N57
|
CS(=O)(=O)N1CCCC[C@H]1C(=O)NCC1(O)CN(C(=O)[C@@H]2COCCC2(F)F)C1
|
CS=O)=O)NCCCC[C@H]6C=O)NCCO)CNC=O)[C@@H]COCCC6F)F))))))))C4
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][O][C][C][C][Ring1][=Branch1][Branch1][C][F][F][C][Ring1][#C]
|
[C@@H]18COCCC1(F)F.N16CCCC[C@H]17.C19(O)CN4C1.CS6(=O)=O.C37=O.C48=O.N35.C59
|
C[C@H](NC1(c2ccc(Cl)cc2)CCC1)C1CC(F)(F)C1
|
C[C@H]NCccccCl)cc6))))))CCC4)))))CCCF)F)C4
|
[C][C@H1][Branch2][Ring1][Branch1][N][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][C][Ring1][O][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1]
|
c16ccc(Cl)cc1.C15CC(F)(F)C1.C146CCC1.C[C@H]35.N34
|
CC(C)[C@@H](C(=O)NCCCCN=[N+]=[N-])[C@H](C)NC(=O)c1cnc2cc[nH]c2c1
|
CCC)[C@@H]C=O)NCCCCN=[N+]=[N-])))))))))[C@H]C)NC=O)ccnccc[nH]c5c9
|
[C][C][Branch1][C][C][C@@H1][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][N][=N+1][=N-1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2]
|
CC(C)[C@@H](C3=O)[C@@H]6C.c17cnc2cc[nH]c2c1.C5CCCN=[N+]=[N-].C47=O.N35.N46
|
C[C@H]1CC[C@@H](CNC(=O)CC2CSC2)N(C(=O)CCc2cccnc2F)C1
|
C[C@H]CC[C@@H]CNC=O)CCCSC4))))))))NC=O)CCccccnc6F))))))))))C6
|
[C][C@H1][C][C][C@@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][C][C][S][C][Ring1][Ring2][N][Branch1][S][C][=Branch1][C][=O][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][F][C][Ring2][Ring1][#Branch2]
|
C[C@H]1CC[C@@H]6N4C1.c18cccnc1F.C4(=O)CC8.C3(=O)C7.C17CSC1.C56.N35
|
C=C1CC[C@@H]1C(=O)N1CC2(C[C@@H](NC(=O)CNC(=O)c3cc(C)nn3C)CO2)C1
|
C=CCC[C@@H]4C=O)NCCC[C@@H]NC=O)CNC=O)cccC)nn5C)))))))))))CO5))))C4
|
[C][=C][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][P][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][N][Ring1][=Branch1][C][C][O][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch1]
|
N14CC2(C[C@@H]8CO2)C1.c19cc(C)nn1C.C=C1CC[C@@H]1%10.C5(=O)C7.C4%10=O.C69=O.N58.N67
|
CC[C@@H](CNC(=O)C1CCC(CO)CC1)NC(=O)C=C1SCC(=O)N1C
|
CC[C@@H]CNC=O)CCCCCO))CC6)))))))))NC=O)C=CSCC=O)N5C
|
[C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring1][C][O][C][C][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][S][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C]
|
C3(=O)C=C1SCC(=O)N1C.C16CCC7CC1.CC[C@H]4C5.C26=O.N25.C7O.N34
|
Cc1sccc1CC(=O)N[C@@H]1CC[C@@H](C)N(C(=O)CC[C@@H]2CCCN2C)C1
|
Ccsccc5CC=O)N[C@@H]CC[C@@H]C)NC=O)CC[C@@H]CCCN5C)))))))))C6
|
[C][C][S][C][=C][C][=Ring1][Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][C][Ring1][P]
|
[C@@H]15CC[C@@H](C)N4C1.Cc1sccc17.[C@@H]16CCCN1C.C4(=O)CC6.C7C3=O.N35
|
CCc1onc(C)c1[C@H](C(=O)Nc1ccccc1)N1CCc2c(CO)n[nH]c2C1
|
CCconcC)c5[C@H]C=O)Ncccccc6))))))))NCCccCO))n[nH]c5C9
|
[C][C][C][O][N][=C][Branch1][C][C][C][=Ring1][=Branch1][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][C][Branch1][Ring1][C][O][=N][NH1][C][=Ring1][#Branch1][C][Ring1][O]
|
N14CCc2c7n[nH]c2C1.c16onc(C)c18.c15ccccc1.[C@@H]48C3=O.CC6.N35.C7O
|
Cn1c(Br)nnc1CNC(=O)c1ccc(-n2cc(CNC(=O)CC#N)nn2)cc1
|
CncBr)nnc5CNC=O)cccc-nccCNC=O)CC#N))))))nn5)))))cc6
|
[C][N][C][Branch1][C][Br][=N][N][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=C][Branch1][#Branch2][C][N][C][=Branch1][C][=O][C][C][#N][N][=N][Ring1][N][C][=C][Ring2][Ring1][C]
|
Cn1c8nnc1Br.c17ccc%10cc1.n1%10cc9nn1.C4(=O)CC#N.C37=O.C58.N35.C69.N46
|
CCNC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCCN1C(=O)C[C@H](O)C1CCCC1
|
CCNC=O)[C@@H]CCCN5C=O)[C@H]CCCCN6C=O)C[C@H]O)CCCCC5
|
[C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C@H1][Branch1][C][O][C][C][C][C][C][Ring1][Branch1]
|
[C@H]17CCCCN14.[C@@H]16CCCN13.C4(=O)C[C@@H]8O.C18CCCC1.C26=O.C37=O.CC5.N25
|
C[C@H](C(=O)N1C[C@@H](NC(=O)C#CC2(C)COC2)[C@H](c2cnn(C)c2)C1)S(C)(=O)=O
|
C[C@H]C=O)NC[C@@H]NC=O)C#CCC)COC4))))))))[C@H]ccnnC)c5)))))C5))))))SC)=O)=O
|
[C][C@H1][Branch2][Ring2][O][C][=Branch1][C][=O][N][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][C][O][C][Ring1][Branch1][C@H1][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring2][Ring1][Branch1][S][Branch1][C][C][=Branch1][C][=O][=O]
|
C4(=O)C#CC1(C)COC1.C[C@H](C3=O)S(C)(=O)=O.N13C[C@@H]5[C@H]6C1.c16cnn(C)c1.N45
|
CC1(CC(=O)N2CC[C@H](CNC(=O)[C@@H]3Cc4ccc(F)cc43)C23CC3)CC1
|
CCCC=O)NCC[C@H]CNC=O)[C@@H]CccccF)cc68)))))))))))C5CC3)))))))))CC3
|
[C][C][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][=Branch2][C][Ring2][Ring1][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][#Branch2]
|
C6(=O)[C@@H]1Cc2ccc(F)cc21.N15CC[C@H]9C12CC2.CC18CC1.C8C5=O.C79.N67
|
C[C@H](C(=O)N1CCN2CCN(C(=O)c3ccc(Br)c(Cl)c3)C[C@H]2C1)n1ccnn1
|
C[C@H]C=O)NCCNCCNC=O)ccccBr)cCl)c6)))))))C[C@H]6C%10)))))))))))nccnn5
|
[C][C@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][Cl][=C][Ring1][Branch2][C][C@H1][Ring1][S][C][Ring2][Ring1][Ring2][N][C][=C][N][=N][Ring1][Branch1]
|
N14CCN2CCN5C[C@H]2C1.c16ccc(Br)c(Cl)c1.C[C@@H]7C4=O.n17ccnn1.C56=O
|
CC[C@H](C)CCC(=O)N1CCC(C)(C)[C@@H](NC(=O)C2=CCC2)C1
|
CC[C@H]C)CCC=O)NCCCC)C)[C@@H]NC=O)C=CCC4))))))C6
|
[C][C][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch1][N][N][C][=Branch1][C][=O][C][=C][C][C][Ring1][Ring2][C][Ring1][#C]
|
N13CCC(C)(C)[C@@H]5C1.CC[C@H](C)CCC3=O.C4(=O)C1=CCC1.N45
|
COC[C@H](CC(C)C)C(=O)N1CCC[C@H](CC(=O)NC(C)(C)[C@H]2CCCOC2)C1
|
COC[C@H]CCC)C)))C=O)NCCC[C@H]CC=O)NCC)C)[C@H]CCCOC6))))))))))C6
|
[C][O][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1]
|
C5[C@H](CC(C)C)C3=O.N13CCC[C@H]7C1.[C@H]18CCCOC1.C7C4=O.C68(C)C.CO5.N46
|
CC1(OCCNC(=O)CONC(=O)[C@@H]2C[C@@H]2C2CCCC2)CCCC1
|
CCOCCNC=O)CONC=O)[C@@H]C[C@@H]3CCCCC5)))))))))))))))))CCCC5
|
[C][C][Branch2][Ring1][N][O][C][C][N][C][=Branch1][C][=O][C][O][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][C][C][C][C][Ring1][Branch1][C][C][C][C][Ring2][Ring1][Branch2]
|
[C@@H]18C[C@@H]1C1CCCC1.CC14CCCC1.O6NC8=O.C3(=O)C6.C5C7.O45.N37
|
C[C@@H]1CCN(C(=O)c2ncnc(O)c2Br)C[C@H]1NC(=O)C1(CF)CC1
|
C[C@@H]CCNC=O)cncncO)c6Br))))))))C[C@H]6NC=O)CCF))CC3
|
[C][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=N][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][Br][C][C@H1][Ring1][S][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][C][Ring1][Branch1]
|
C[C@@H]1CCN3C[C@H]15.c16ncnc(O)c1Br.C178CC1.C36=O.C47=O.N45.C8F
|
CC(=O)N[C@@H](CC(C)C)C(=O)N(C)CC1CN(S(=O)(=O)c2c(C)cccc2Cl)C1
|
CC=O)N[C@@H]CCC)C)))C=O)NC)CCCNS=O)=O)ccC)cccc6Cl))))))))C4
|
[C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][Branch2][Ring1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][Cl][C][Ring1][#C]
|
S7(=O)(=O)c1c(C)cccc1Cl.[C@H]5(CC(C)C)C4=O.C18CN7C1.CC3=O.N46C.N35.C68
|
C=CC[C@]1(C(=O)NCCCCN=[N+]=[N-])CCN(C(=O)[C@@H]([C@@H](C)CC)N(C)C)C1
|
C=CC[C@]C=O)NCCCCN=[N+]=[N-])))))))))CCNC=O)[C@@H][C@@H]C)CC)))NC)C))))C5
|
[C][=C][C][C@][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][N][=N+1][=N-1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C@@H1][Branch1][C][C][C][C][N][Branch1][C][C][C][C][Ring2][Ring1][=Branch2]
|
C3(=O)[C@H]5[C@@H](C)CC.[C@]167CCN3C1.C4CCCN=[N+]=[N-].C=CC7.C26=O.N5(C)C.N24
|
CCn1cc(C(=O)N2CC(CNC(=O)CCCCCCc3ccccc3)C2)nn1
|
CCnccC=O)NCCCNC=O)CCCCCCcccccc6)))))))))))))))C4)))))nn5
|
[C][C][N][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][N][=N][Ring2][Ring1][O]
|
C5(=O)CCCCCC%10.n18cc7nn1.c1%10ccccc1.N14CC9C1.C47=O.CC8.C69.N56
|
COc1cccc(C(=O)N2CCOC[C@@H]2CNC(=O)Cc2cccc(C)c2)c1N
|
COcccccC=O)NCCOC[C@@H]6CNC=O)CcccccC)c6)))))))))))))))))c6N
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][#Branch2][N]
|
c15cccc7c1N.N13CCOC[C@@H]18.c19cccc(C)c1.C4(=O)C9.C37=O.CO5.C68.N46
|
CC[C@H](C)CC(=O)C(=O)N[C@]1(C(=O)NC2CC3(CC(C#N)C3)C2)C[C@H]1C
|
CC[C@H]C)CC=O)C=O)N[C@]C=O)NCCCCCC#N))C4)))C4))))))C[C@H]3C
|
[C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][#Branch2][C][C][Branch1][Ring1][C][#N][C][Ring1][=Branch1][C][Ring1][=Branch2][C][C@H1][Ring1][#C][C]
|
CC[C@H](C)CC(=O)C4=O.C17CC2(C1)CC(C#N)C2.[C@@]168C[C@H]1C.C58=O.N46.N57
|
C[C@@H]1CCc2[nH]c(C(=O)NC3CCN(C(=O)[C@@H](C)CC(F)(F)F)CC3)cc2C1
|
C[C@@H]CCc[nH]cC=O)NCCCNC=O)[C@@H]C)CCF)F)F)))))CC6))))))))cc5C9
|
[C][C@@H1][C][C][C][NH1][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][#C][=C][C][=Ring2][Ring1][#Branch1][C][Ring2][Ring1][O]
|
C[C@@H]1CCc2[nH]c7cc2C1.C5(=O)[C@@H](C)CC(F)(F)F.C16CCN5CC1.C47=O.N46
|
COCc1ccc(C(=O)N[C@H](CNC(=O)c2nc(C)n(C3CC3)c2C)C(C)C)o1
|
COCccccC=O)N[C@H]CNC=O)cncC)nCCC3)))c5C)))))))))CC)C)))))o5
|
[C][O][C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][N][=C][Branch1][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=Ring1][=Branch2][C][C][Branch1][C][C][C][O][Ring2][Ring1][#Branch2]
|
c1%10nc(C)n%12c1C.c1%11ccc9o1.[C@@H]7(C8)C(C)C.C49=O.C5%10=O.C1%12CC1.CO6.C6%11.N47.N58
|
CC1=NO[C@@](C)(C(=O)NC[C@@](C)(NC(=O)c2cc(Cl)c(F)cc2Cl)C(C)C)C1
|
CC=NO[C@@]C)C=O)NC[C@@]C)NC=O)cccCl)cF)cc6Cl)))))))))CC)C))))))C5
|
[C][C][=N][O][C@@][Branch1][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][F][C][=C][Ring1][Branch2][Cl][C][Branch1][C][C][C][C][Ring2][Ring1][O]
|
c18cc(Cl)c(F)cc1Cl.CC1=NO[C@]7(C)C1.C5[C@]6(C)C(C)C.C37=O.C48=O.N35.N46
|
CCCCCC[C@H](C)CC(=O)NCCN(C(=O)CNC(=O)C(F)(F)F)C1CC1
|
CCCCCC[C@H]C)CC=O)NCCNC=O)CNC=O)CF)F)F))))))CCC3
|
[C][C][C][C][C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][C][C][Ring1][Ring1]
|
CCCCCC[C@H](C)CC2=O.C4(=O)C(F)(F)F.C3(=O)C7.C5C6.N368.C18CC1.N25.N47
|
C[C@@](CNC(=O)c1cnnc(O)c1)(NC(=O)c1cccc2c1CCC2)C1CCC1
|
C[C@@]CNC=O)ccnncO)c6)))))))))NC=O)cccccc6CCC5)))))))))))CCCC4
|
[C][C@@][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][N][=N][C][Branch1][C][O][=C][Ring1][#Branch1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Branch1][C][C][C][C][Ring1][Ring2]
|
c18cccc2c1CCC2.c17cnnc(O)c1.C[C@@]59C6.C19CCC1.C37=O.C48=O.N36.N45
|
COc1cc(C(=O)NCCNC(=O)[C@H]2CC[C@@H](C(N)=O)O2)c(F)cn1
|
COcccC=O)NCCNC=O)[C@H]CC[C@@H]CN)=O))O5)))))))))))cF)cn6
|
[C][O][C][=C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C@@H1][Branch1][=Branch1][C][Branch1][C][N][=O][O][Ring1][Branch2][=C][Branch1][C][F][C][=N][Ring2][Ring1][#Branch1]
|
c15cc%10c(F)cn1.[C@H]18CC[C@@H]9O1.C3%10=O.C6C7.C48=O.C9(N)=O.CO5.N36.N47
|
CC(C)CC1(C(=O)NC[C@@]2(C)CCN(C(=O)[C@H]3CCN(C)S3(=O)=O)C2)COC1
|
CCC)CCC=O)NC[C@@]C)CCNC=O)[C@H]CCNC)S5=O)=O)))))))C5))))))))COC4
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][C][C][S][Ring1][=Branch1][=Branch1][C][=O][=O][C][Ring1][S][C][O][C][Ring2][Ring1][Branch2]
|
[C@H]17CCN(C)S1(=O)=O.[C@]1%10(C)CCN5C1.C189COC1.CC(C)C9.C48=O.C57=O.N46.C6%10
|
CC(=O)N[C@H](C(=O)N1CC[C@H]1CNC(=O)c1cn2ccncc2n1)C(C)C
|
CC=O)N[C@H]C=O)NCC[C@H]4CNC=O)ccnccncc6n9)))))))))))))))))CC)C
|
[C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][N][C][=C][N][=C][C][Ring1][=Branch1][=N][Ring1][=Branch2][C][Branch1][C][C][C]
|
c18cn2ccncc2n1.[C@@H]6(C4=O)C(C)C.N14CC[C@H]19.CC3=O.C58=O.N36.C79.N57
|
CC(=CC1CC1)C(=O)N1C[C@H]2CCC[C@@]2(NC(=O)c2ncsc2Br)C1
|
CC=CCCC3))))C=O)NC[C@H]CCC[C@@]5NC=O)cncsc5Br))))))))C8
|
[C][C][=Branch1][#Branch1][=C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@][Ring1][Branch1][Branch1][=C][N][C][=Branch1][C][=O][C][N][=C][S][C][=Ring1][Branch1][Br][C][Ring1][P]
|
N13C[C@H]2CCC[C@@]25C1.c16ncsc1Br.CC=7C3=O.C=7C1CC1.C46=O.N45
|
C[C@@H]1[C@H](C)[C@@H]1C(=O)N1CCN(C(=O)Cn2ccccc2=O)[C@H](c2cnn(C)c2)C1
|
C[C@@H][C@H]C)[C@@H]3C=O)NCCNC=O)Cnccccc6=O)))))))))[C@H]ccnnC)c5)))))C6
|
[C][C@@H1][C@H1][Branch1][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][=C][C][=C][C][Ring1][=Branch1][=O][C@H1][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
N13CCN4[C@H]7C1.n16ccccc1=O.c17cnn(C)c1.C[C@H]1[C@@H]5[C@H]1C.C4(=O)C6.C35=O
|
C[C@@H](CCNC(=O)Cc1csc(=N)[nH]1)NC(=O)[C@H]1C(F)(F)C12CC2
|
C[C@@H]CCNC=O)Cccsc=N)[nH]5))))))))))NC=O)[C@H]CF)F)C3CC3
|
[C][C@@H1][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][=Branch1][C][=N][NH1][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch1][C][C][Ring1][Ring1]
|
[C@H]17C(F)(F)C12CC2.c18csc(=N)[nH]1.C[C@H]5CC6.C3(=O)C8.C47=O.N36.N45
|
COc1cc(NC(=O)C[C@@H]2CCN(Cc3ccc(Cl)c(O)c3)C2)cc(OC)c1
|
COcccNC=O)C[C@@H]CCNCccccCl)cO)c6)))))))C5))))))))ccOC))c6
|
[C][O][C][=C][C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][C@@H1][C][C][N][Branch1][S][C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][=C][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][#Branch2]
|
c15cc6cc8c1.c1%10ccc(Cl)c(O)c1.[C@@H]19CCN7C1.C4(=O)C9.CO5.N48.C7%10.O6C
|
Cc1cn2c(n1)C[C@@H](C(=O)N(C1CCCCC1)C1CCCCC1)C2
|
Cccncn5)C[C@@H]C=O)NCCCCCC6))))))CCCCCC6))))))))C5
|
[C][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C@@H1][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][C][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Branch1]
|
Cc1cn2c(n1)C[C@@H]6C2.C14CCCCC1.C15CCCCC1.C36=O.N345
|
O=C(C[C@H]1CCN(C(=O)c2c[nH]c3ccc(Br)cc23)C1)NC[C@H](O)C(F)(F)F
|
O=CC[C@H]CCNC=O)cc[nH]ccccBr)cc96))))))))))C5))))))NC[C@H]O)CF)F)F
|
[O][=C][Branch2][Ring1][S][C][C@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][Ring1][P][N][C][C@H1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F]
|
c17c[nH]c2ccc(Br)cc12.C6[C@H](O)C(F)(F)F.[C@H]18CCN5C1.O=C4C8.C57=O.N46
|
Cc1ncsc1CCNC(=O)[C@@H](NC(=O)[C@H]1[C@H]2CCC(F)(F)[C@H]21)C(C)(C)C
|
Ccncsc5CCNC=O)[C@@H]NC=O)[C@H][C@H]CCCF)F)[C@H]56))))))))CC)C)C
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][C@H1][C][C][C][Branch1][C][F][Branch1][C][F][C@H1][Ring1][#Branch1][Ring1][Branch2][C][Branch1][C][C][Branch1][C][C][C]
|
C3(=O)[C@@H]6C(C)(C)C.[C@H]17[C@H]2CCC(F)(F)[C@@H]12.Cc1ncsc18.C8C5.C47=O.N35.N46
|
CCc1nc(C(=O)N[C@@H]2C[C@H]2C2CCN(C(=O)Cc3cncnc3)CC2)co1
|
CCcncC=O)N[C@@H]C[C@H]3CCCNC=O)Cccncnc6))))))))CC6)))))))))))co5
|
[C][C][C][=N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][=C][N][=C][N][=C][Ring1][=Branch1][C][C][Ring1][#C][=C][O][Ring2][Ring1][#Branch2]
|
[C@@H]16C[C@H]1C1CCN5CC1.c18nc7co1.c19cncnc1.C5(=O)C9.C47=O.CC8.N46
|
CCn1ncnc1[C@@H](NCCCO)c1nnnn1[C@@H](C)c1ccccc1
|
CCnncnc5[C@@H]NCCCO)))))cnnnn5[C@@H]C)cccccc6
|
[C][C][N][N][=C][N][=C][Ring1][Branch1][C@@H1][Branch1][=Branch1][N][C][C][C][O][C][=N][N][=N][N][Ring1][Branch1][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
n14ncnc16.c17nnnn15.c18ccccc1.C3CCO.[C@@H]267.[C@@H]58C.CC4.N23
|
CC[C@H](CN(C)C(=O)c1cnc(O)cc1OC)NC(=O)CCCF
|
CC[C@H]CNC)C=O)ccncO)cc6OC)))))))))))NC=O)CCCF
|
[C][C][C@H1][Branch2][Ring1][#Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][C][N][C][=Branch1][C][=O][C][C][C][F]
|
c17cnc(O)cc14.C3(=O)CCCF.CC[C@@H]5C6.N26C.C27=O.O4C.N35
|
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