SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(=O)OC1CCN(C(=O)C[C@]23CC[C@@H]2CN(C(=O)[C@](C)(O)CC(C)C)C3)CC1
|
CC=O)OCCCNC=O)C[C@]CC[C@@H]4CNC=O)[C@]C)O)CCC)C)))))C7)))))))))CC6
|
[C][C][=Branch1][C][=O][O][C][C][C][N][Branch2][Ring2][Branch1][C][=Branch1][C][=O][C][C@][C][C][C@@H1][Ring1][Ring2][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][C][O][C][C][Branch1][C][C][C][C][Ring1][S][C][C][Ring2][Ring1][=Branch2]
|
C6(=O)[C@](C)(O)CC(C)C.[C@]128CC[C@@H]1CN6C2.C17CCN5CC1.C5(=O)C8.CC4=O.O47
|
CC(C)C[C@@H](C(=O)N[C@H]1CCN(C(=O)C[C@@H]2OCCC2(C)C)[C@@H](C)C1)C(C)C
|
CCC)C[C@@H]C=O)N[C@H]CCNC=O)C[C@@H]OCCC5C)C))))))))[C@@H]C)C6))))))))CC)C
|
[C][C][Branch1][C][C][C][C@@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C@@H1][O][C][C][C][Ring1][Branch1][Branch1][C][C][C][C@@H1][Branch1][C][C][C][Ring1][P][C][Branch1][C][C][C]
|
CC(C)C[C@@H](C3=O)C(C)C.[C@H]15CCN4[C@@H](C)C1.[C@@H]16OCCC1(C)C.C4(=O)C6.N35
|
COC(=O)c1cscc1NC(=O)[C@H]1CN(C(=O)[C@@H](C)OC)CCO1
|
COC=O)ccscc5NC=O)[C@H]CNC=O)[C@@H]C)OC))))CCO6
|
[C][O][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][C][N][Branch1][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][C][O][Ring1][N]
|
[C@H]17CN4CCO1.c18cscc16.C4(=O)[C@H]5C.C28=O.C37=O.CO2.N36.O5C
|
COCCNC(=NCCc1ccc(C)cn1)NCC(F)(F)C(C)(C)C
|
COCCNC=NCCccccC)cn6)))))))))NCCF)F)CC)C)C
|
[C][O][C][C][N][C][=Branch1][#C][=N][C][C][C][=C][C][=C][Branch1][C][C][C][=N][Ring1][#Branch1][N][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][C][Branch1][C][C][C]
|
N3C(=NCC5)N4.C4C(F)(F)C(C)(C)C.c15ccc(C)cn1.C2C3.CO2
|
CO[C@H]1C[C@@H](NC(=O)C2C[C@H]3CC[C@@H](C2)S3)CN(C(=O)c2cn[nH]c2)C1
|
CO[C@H]C[C@@H]NC=O)CC[C@H]CC[C@@H]C7)S5)))))))))CNC=O)ccn[nH]c5))))))C6
|
[C][O][C@H1][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][S][Ring1][=Branch1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring2][Ring1][Branch2]
|
[C@H]16C[C@@H]7CN5C1.C18C[C@H]2CC[C@@H](C1)S2.c19cn[nH]c1.C48=O.C59=O.CO6.N47
|
CC#CC1CN(C(=O)CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccsc3)C2)C1
|
CC#CCCNC=O)CC[C@@H]CCNC=O)[C@@H]C)cccsc5)))))))C5))))))))C4
|
[C][C][#C][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C][C][C@@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][=C][C][Ring2][Ring1][=Branch1]
|
CC#CC1CN4C1.[C@@H]16CCN5C1.C4(=O)CC6.C5(=O)[C@H]7C.c17ccsc1
|
Cc1ccc2c(C(=O)NC[C@H](C)N(C)C(=O)C#CC3(C)CC3)cnn2c1C
|
CcccccC=O)NC[C@H]C)NC)C=O)C#CCC)CC3)))))))))))cnn5c9C
|
[C][C][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][C][C][Ring1][Ring2][C][=N][N][Ring2][Ring1][Branch1][C][=Ring2][Ring1][=Branch2][C]
|
Cc1ccc2c8cnn2c1C.C5(=O)C#CC1(C)CC1.C6[C@@H]7C.C48=O.N57C.N46
|
CCN(C(=O)c1nc(Cl)oc1C)[C@@H](C)C(=O)N(C)CC(=O)NC
|
CCNC=O)cncCl)oc5C)))))))[C@@H]C)C=O)NC)CC=O)NC
|
[C][C][N][Branch1][S][C][=Branch1][C][=O][C][N][=C][Branch1][C][Cl][O][C][=Ring1][=Branch1][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C]
|
c18nc(Cl)oc1C.[C@H]6(C)C3=O.C7C4=O.N256.C28=O.N37C.CC5.N4C
|
Cc1cccnc1C(=O)N1CCN(C(=O)CN(C)C(=O)CC2(O)CC2)CC1
|
Cccccnc6C=O)NCCNC=O)CNC)C=O)CCO)CC3))))))))CC6
|
[C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][Ring1][Ring2][C][C][Ring2][Ring1][C]
|
Cc1cccnc17.N13CCN4CC1.C4(=O)C6.C5(=O)C8.C18(O)CC1.C37=O.N56C
|
COC(=O)[C@]12CCCC[C@H]1CN(CC[C@H]1COC(C)(C)C1)C2
|
COC=O)[C@]CCCC[C@H]6CNCC[C@H]COCC)C)C5)))))))C9
|
[C][O][C][=Branch1][C][=O][C@][C][C][C][C][C@H1][Ring1][=Branch1][C][N][Branch1][S][C][C][C@H1][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][C]
|
[C@]125CCCC[C@H]1CN4C2.[C@H]16COC(C)(C)C1.C35=O.C4C6.CO3
|
O=C(c1ccccc1NC1CCCCC1)N1CC[C@H]2[C@@H]1CCCN2CCO
|
O=Ccccccc6NCCCCCC6)))))))))))))NCC[C@H][C@@H]5CCCN6CCO
|
[O][=C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][C][C][C][Ring1][=Branch1][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][C][O]
|
N13CC[C@H]2[C@@H]1CCCN24.c17ccccc15.C16CCCCC1.O=C37.C4CO.N56
|
Cc1ncsc1C(=O)N1CCCN(C(=O)[C@@H]2COc3ccc(Cl)cc32)[C@@H](CO)C1
|
Ccncsc5C=O)NCCCNC=O)[C@@H]COccccCl)cc69))))))))))[C@@H]CO))C7
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Ring1][#Branch2][C@@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][Branch1]
|
C5(=O)[C@@H]1COc2ccc(Cl)cc21.N14CCCN5[C@@H]7C1.Cc1ncsc16.C46=O.C7O
|
CC[C@H](C)N(CC(=O)OC)C(=O)[C@H](OC)c1ccc(Cl)cc1
|
CC[C@H]C)NCC=O)OC))))C=O)[C@H]OC))ccccCl)cc6
|
[C][C][C@H1][Branch1][C][C][N][Branch1][Branch2][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][C@H1][Branch1][Ring1][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
c17ccc(Cl)cc1.C3(=O)[C@H]47.CC[C@@H]5C.C6C2=O.N356.O2C.O4C
|
CCC=CC(=O)N1CC[C@@H](CNC(=O)c2ccc3cccnc3n2)C1
|
CCC=CC=O)NCC[C@@H]CNC=O)cccccccnc6n%10)))))))))))))C5
|
[C][C][C][=C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][Ring2][Ring1][Ring1]
|
c17ccc2cccnc2n1.N14CC[C@@H]9C1.C=8C4=O.CCC=8.C57=O.C69.N56
|
COCCCCNS(=O)(=O)c1ccc2sc(Cl)cc2c1
|
COCCCCNS=O)=O)ccccscCl)cc5c9
|
[C][O][C][C][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][S][C][Branch1][C][Cl][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2]
|
S5(=O)(=O)c1ccc2sc(Cl)cc2c1.C3CCC4.CO3.N45
|
CCn1ccc(C(=O)N2CC3(CCCN(C(=O)c4oncc4C)C3)C2)n1
|
CCncccC=O)NCCCCCNC=O)concc5C)))))))C6)))))C4)))))n5
|
[C][C][N][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][O][N][=C][C][=Ring1][Branch1][C][C][Ring1][=C][C][Ring1][P][=N][Ring2][Ring1][Branch2]
|
N15CC2(CCCN6C2)C1.n19ccc7n1.c18oncc1C.C57=O.C68=O.CC9
|
COc1ccc(S(=O)(=O)N2CCC[C@]3(CCN3C(=O)[C@@H](C)S)C2)cc1F
|
COccccS=O)=O)NCCC[C@]CCN4C=O)[C@@H]C)S))))))C6)))))))cc6F
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C@][Branch1][#C][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C@@H1][Branch1][C][C][S][C][Ring1][=C][C][=C][Ring2][Ring1][#Branch1][F]
|
c15ccc(S6(=O)=O)cc1F.N16CCC[C@]2(CCN24)C1.C4(=O)[C@@H](C)S.CO5
|
Cc1cc(Cl)cc(C(=O)N[C@@H](c2cccc(F)c2)c2cccc(Br)c2)c1
|
CcccCl)ccC=O)N[C@@H]cccccF)c6))))))cccccBr)c6)))))))))c6
|
[C][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][=C][Ring2][Ring1][=Branch2]
|
Cc1cc5cc(Cl)c1.c16cccc(F)c1.c17cccc(Br)c1.C35=O.[C@H]467.N34
|
C[C@@H]1[C@H](NC(=O)/C=C/C2CCN(C(=O)[C@H](O)C3CCC3)CC2)CCCN1C
|
C[C@@H][C@H]NC=O)/C=C/CCCNC=O)[C@H]O)CCCC4))))))CC6))))))))))CCCN6C
|
[C][C@@H1][C@H1][Branch2][Ring1][S][N][C][=Branch1][C][=O][/C][=C][/C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][C][Ring1][Ring2][C][C][Ring1][=C][C][C][C][N][Ring2][Ring1][=Branch2][C]
|
C[C@@H]1[C@H]6CCCN1C.C=7C1CCN5CC1.C5(=O)[C@@H]8O.C4(=O)C=7.C18CCC1.N46
|
CC[C@@H](O)CN(C(=O)CC(C)(C)CNC(=O)CC[C@H]1CCCN1C)C1CC1
|
CC[C@@H]O)CNC=O)CCC)C)CNC=O)CC[C@H]CCCN5C))))))))))))))CCC3
|
[C][C][C@@H1][Branch1][C][O][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][C][C][C][Ring1][Ring1]
|
C2(=O)CC(C)(C)C5.[C@H]17CCCN1C.CC[C@@H](O)C4.C3(=O)CC7.N246.C16CC1.N35
|
COCC=CC(=O)N1CC[C@H](NC(=O)c2scnc2C(C)(C)C)[C@H](F)C1
|
COCC=CC=O)NCC[C@H]NC=O)cscnc5CC)C)C)))))))))[C@H]F)C6
|
[C][O][C][C][=C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][S][C][=N][C][=Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][C@H1][Branch1][C][F][C][Ring2][Ring1][Ring1]
|
N13CC[C@H]6[C@H](F)C1.c17scnc19.C=8C3=O.C9(C)(C)C.C5C=8.C47=O.CO5.N46
|
C[C@H](O)C(=O)N1CCC[C@H](NC(=O)c2cnc(F)c(Cl)c2)[C@@H]1C
|
C[C@H]O)C=O)NCCC[C@H]NC=O)ccncF)cCl)c6))))))))[C@@H]6C
|
[C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][C@@H1][Ring1][P][C]
|
N13CCC[C@H]5[C@@H]1C.c16cnc(F)c(Cl)c1.C[C@H](O)C3=O.C46=O.N45
|
Cn1ncc(NC(=O)[C@H](O)C2CCC2)c1-c1cn(CC[C@@H]2CC2(Cl)Cl)nn1
|
CnnccNC=O)[C@H]O)CCCC4)))))))c5-ccnCC[C@@H]CC3Cl)Cl))))))nn5
|
[C][N][N][=C][C][Branch1][S][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][C][Ring1][Ring2][=C][Ring1][=C][C][=C][N][Branch1][N][C][C][C@@H1][C][C][Ring1][Ring1][Branch1][C][Cl][Cl][N][=N][Ring1][N]
|
Cn1ncc4c18.c18cn5nn1.C3(=O)[C@@H]6O.[C@@H]17CC1(Cl)Cl.C16CCC1.C5C7.N34
|
CC(C)(C)CC(=O)NC1CC2(CC[C@@H](CNC(=O)[C@H](O)Cc3cnc[nH]3)OC2)C1
|
CCC)C)CC=O)NCCCCC[C@@H]CNC=O)[C@H]O)Cccnc[nH]5))))))))))OC6)))))C4
|
[C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=C][C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][=C][N][=C][NH1][Ring1][Branch1][O][C][Ring2][Ring1][C][C][Ring2][Ring1][Branch1]
|
C17CC2(CC[C@@H]8OC2)C1.CC(C)(C)CC4=O.C5(=O)[C@H](O)C9.c19cnc[nH]1.N47.C68.N56
|
C[C@@H]1C[C@@H](C(=O)NOCCC(F)(F)F)C1(C)C
|
C[C@@H]C[C@@H]C=O)NOCCCF)F)F)))))))C4C)C
|
[C][C@@H1][C][C@@H1][Branch1][P][C][=Branch1][C][=O][N][O][C][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=C][Branch1][C][C][C]
|
C[C@@H]1C[C@@H]3C1(C)C.C2CC(F)(F)F.C3(=O)NO2
|
C=CCNC(=O)[C@@H](c1nocc1C)N1CCC(COC)CC1
|
C=CCNC=O)[C@@H]cnocc5C))))))NCCCCOC)))CC6
|
[C][=C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=Branch2][C][=N][O][C][=C][Ring1][Branch1][C][N][C][C][C][Branch1][Ring2][C][O][C][C][C][Ring1][=Branch2]
|
N15CCC7CC1.c16nocc1C.C2(=O)[C@H]56.C=CC4.N24.C37.O3C
|
COCCO[C@@H](C)C(=O)N1CCN(C(=O)C(=O)Nc2ncc[nH]2)C[C@](C)(F)C1
|
COCCO[C@@H]C)C=O)NCCNC=O)C=O)Ncncc[nH]5))))))))C[C@]C)F)C7
|
[C][O][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=N][C][=C][NH1][Ring1][Branch1][C][C@][Branch1][C][C][Branch1][C][F][C][Ring2][Ring1][Ring1]
|
N13CCN4C[C@](C)(F)C1.[C@H]8(C)C3=O.C4(=O)C5=O.c19ncc[nH]1.C6C7.CO6.O78.N59
|
C#CCCC[C@H](C)C(=O)N1CCC(CCC(=O)N[C@H](CC)C(C)C)CC1
|
C#CCCC[C@H]C)C=O)NCCCCCC=O)N[C@H]CC))CC)C)))))))CC6
|
[C][#C][C][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][Branch1][C][C][C][C][C][Ring1][P]
|
C#CCCC[C@H](C)C2=O.N12CCC5CC1.[C@@H]4(CC)C(C)C.C5CC3=O.N34
|
C#Cc1ccc(C(=O)NCC[C@H](C)NC(=O)CCNC(=O)COC)cc1
|
C#CccccC=O)NCC[C@H]C)NC=O)CCNC=O)COC))))))))))))))cc6
|
[C][#C][C][=C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][O][C][C][=C][Ring2][Ring1][Branch2]
|
C#Cc1ccc9cc1.C6C[C@@H]7C.C3(=O)CC8.C4(=O)C5.C29=O.N26.N37.N48.O5C
|
CC#CC[C@H](NC(=O)C[C@H]1CSCCO1)C(=O)N[C@@H](CCO)COC
|
CC#CC[C@H]NC=O)C[C@H]CSCCO6)))))))))C=O)N[C@@H]CCO)))COC
|
[C][C][#C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C@H1][C][S][C][C][O][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring2][C][C][O][C][O][C]
|
CC#CC[C@H]5C3=O.[C@H]17CSCCO1.[C@@H]6(C4)CCO.C2(=O)C7.N25.N36.O4C
|
Cc1nsc(C(=O)N[C@@H](CO)CNC(=O)Cc2ccccc2S(C)(=O)=O)c1N
|
CcnscC=O)N[C@@H]CO))CNC=O)Ccccccc6SC)=O)=O)))))))))))))))c5N
|
[C][C][=N][S][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring2][Ring1][#Branch2][N]
|
c18ccccc1S(C)(=O)=O.Cc1nsc7c1N.[C@@H]5(C6)CO.C4(=O)C8.C37=O.N35.N46
|
COC1(C(=O)N(C)C[C@@H](C)NC(=O)[C@@H]2CCC23CCOCC3)CCCCC1
|
COCC=O)NC)C[C@@H]C)NC=O)[C@@H]CCC4CCOCC6)))))))))))))))CCCCC6
|
[C][O][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][Ring1][Ring2][C][C][O][C][C][Ring1][=Branch1][C][C][C][C][C][Ring2][Ring1][=Branch2]
|
[C@@H]1%10CCC12CCOCC2.C169CCCCC1.C7[C@H]8C.C49=O.N47C.C5%10=O.CO6.N58
|
COC(=O)c1ccc(Cl)nc1NC(=O)[C@@H]1C[C@H](C)CN1C(=O)C1CCSCC1
|
COC=O)ccccCl)nc6NC=O)[C@@H]C[C@H]C)CN5C=O)CCCSCC6
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][S][C][C][Ring1][=Branch1]
|
c18ccc(Cl)nc15.[C@@H]16C[C@H](C)CN14.C17CCSCC1.C28=O.C36=O.C47=O.CO2.N35
|
CCn1c(CNC(=O)C[C@H]2CCCCN2C(=O)[C@@H]2Cc3nccn3C2)cnc1C
|
CCncCNC=O)C[C@H]CCCCN6C=O)[C@@H]Ccnccn5C8)))))))))))))))))))cnc5C
|
[C][C][N][C][Branch2][Ring1][S][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][=N][C][=C][N][Ring1][Branch1][C][Ring1][Branch2][=C][N][=C][Ring2][Ring1][#Branch2][C]
|
[C@@H]17Cc2nccn2C1.n18c%10cnc1C.[C@H]19CCCCN15.C4(=O)C9.C57=O.CC8.C6%10.N46
|
COCC(=O)NCCC(=O)N[C@H]1C[C@H](F)CN(C(=O)C(C)(C)C2CCOCC2)C1
|
COCC=O)NCCC=O)N[C@H]C[C@H]F)CNC=O)CC)C)CCCOCC6))))))))C6
|
[C][O][C][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][C][F][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
[C@H]18C[C@H](F)CN5C1.C5(=O)C9(C)C.C19CCOCC1.C7CC4=O.C6C3=O.CO6.N37.N48
|
Cc1ccnnc1C(=O)N1CCC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@H]1C
|
Ccccnnc6C=O)NCCC[C@@H]NC=O)ccF)cccF)c6Cl)))))))))[C@H]6C
|
[C][C][=C][C][=N][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][Branch1][C][F][=C][Ring1][Branch2][Cl][C@H1][Ring2][Ring1][C][C]
|
c17c(F)ccc(F)c1Cl.N13CCC[C@@H]5[C@H]1C.Cc1ccnnc16.C36=O.C47=O.N45
|
CC1=C(C(=O)NCC2(F)CCN(C(=O)c3ncc(C(F)(F)F)n3C)CC2)CCC1
|
CC=CC=O)NCCF)CCNC=O)cnccCF)F)F))n5C)))))))CC6)))))))))CCC5
|
[C][C][=C][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=N][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][Ring1][=Branch2][C][C][C][Ring2][Ring1][Ring1][C][C][C][Ring2][Ring1][N]
|
CC1=C(C4=O)CCC1.C19(F)CCN5CC1.c17ncc8n1C.C8(F)(F)F.C57=O.N46.C69
|
CC[C@@H](O)C(F)(F)C(=O)N1CC(OCC(=O)N[C@]23CCC[C@H]2C3)C1
|
CC[C@@H]O)CF)F)C=O)NCCOCC=O)N[C@]CCC[C@H]5C6))))))))))C4
|
[C][C][C@@H1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][O][C][C][=Branch1][C][=O][N][C@][C][C][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][C][Ring1][#C]
|
CC[C@@H](O)C(F)(F)C4=O.[C@]128CCC[C@H]1C2.N14CC7C1.C6C5=O.O67.N58
|
CO[C@@](C)(CO)C(=O)N[C@@H]1CCCN(C(=O)c2cc3n[nH]cc3cc2C)C1
|
CO[C@@]C)CO))C=O)N[C@@H]CCCNC=O)cccn[nH]cc5cc9C)))))))))))C6
|
[C][O][C@@][Branch1][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=N][NH1][C][=C][Ring1][Branch1][C][=C][Ring1][=Branch2][C][C][Ring2][Ring1][C]
|
c18cc2n[nH]cc2cc1C.[C@@]6(C)(CO)C4=O.[C@@H]17CCCN5C1.C58=O.CO6.N47
|
C[C@H]1CN(C(=O)c2cscc2C(F)F)CCCN1C(=O)C[C@@H]1CCC[C@H]1O
|
C[C@H]CNC=O)ccscc5CF)F))))))))CCCN7C=O)C[C@@H]CCC[C@H]5O
|
[C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][Branch1][C][F][F][C][C][C][N][Ring1][P][C][=Branch1][C][=O][C][C@@H1][C][C][C][C@H1][Ring1][Branch1][O]
|
C[C@H]1CN3CCCN14.c15cscc17.[C@@H]16CCC[C@H]1O.C4(=O)C6.C35=O.C7(F)F
|
CC(C)n1ncc2c(N[C@@H]3CC[C@H](CO)C3)[nH]c(=NCc3cccnc3Br)nc21
|
CCC)nncccN[C@@H]CC[C@H]CO))C5))))))[nH]c=NCccccnc6Br)))))))))nc69
|
[C][C][Branch1][C][C][N][N][=C][C][=C][Branch1][=N][N][C@@H1][C][C][C@H1][Branch1][Ring1][C][O][C][Ring1][#Branch1][NH1][C][=Branch1][N][=N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Br][N][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][#Branch2]
|
n16ncc2c4[nH]c(=NC8)nc21.c18cccnc1Br.[C@@H]15CC[C@H]7C1.CC6C.N45.C7O
|
CCOCC(=O)NC[C@H]1C[C@](F)(CNC(=O)C2(CCF)CCC2)C1
|
CCOCC=O)NC[C@H]C[C@]F)CNC=O)CCCF)))CCC4)))))))C4
|
[C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][C][C@][Branch1][C][F][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][Branch1][Ring2][C][C][F][C][C][C][Ring1][#Branch1][C][Ring1][S]
|
[C@H]1%11C[C@@]%12(F)C1.C1%104CCC1.C7C3=O.C5%10=O.C4CF.CC6.O67.N38.C8%11.C9%12.N59
|
CO[C@](C)(CO)CNC(=O)c1ccc(SC2CCCC2)c(C(F)(F)F)c1
|
CO[C@]C)CO))CNC=O)ccccSCCCCC5))))))cCF)F)F))c6
|
[C][O][C@][Branch1][C][C][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][S][C][C][C][C][C][Ring1][Branch1][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][S]
|
c16ccc9c7c1.[C@@]4(C)(C5)CO.C18CCCC1.C7(F)(F)F.C36=O.CO4.N35.S89
|
C=C[C@H](C)CC(=O)N1C[C@H](CNC(=O)Cc2ccc(Cl)nc2C)[C@H](O)C1
|
C=C[C@H]C)CC=O)NC[C@H]CNC=O)CccccCl)nc6C)))))))))))[C@H]O)C5
|
[C][=C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][C][C@H1][Branch1][C][O][C][Ring2][Ring1][Ring1]
|
c17ccc(Cl)nc1C.C=C[C@H](C)CC3=O.N13C[C@@H](O)[C@@H]6C1.C4(=O)C7.C56.N45
|
COC(=O)CC1(CC(=O)NC[C@@H](O)CN(C)C(=O)CCNC(=O)CC(C)C)CC1
|
COC=O)CCCC=O)NC[C@@H]O)CNC)C=O)CCNC=O)CCC)C)))))))))))))))CC3
|
[C][O][C][=Branch1][C][=O][C][C][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][Branch2]
|
C5(=O)CC(C)C.C6[C@@H](O)C7.C4(=O)CC8.C2(=O)C9.C19%10CC1.C%10C3=O.N47C.CO2.N36.N58
|
C[C@H](CS(C)(=O)=O)C(=O)N1C[C@@H]2CC[C@@]2(C(=O)Nc2c(C#N)cnn2CCO)C1
|
C[C@H]CSC)=O)=O)))C=O)NC[C@@H]CC[C@@]4C=O)NccC#N))cnn5CCO))))))))))C7
|
[C][C@H1][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@][Ring1][Ring2][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][Branch1][Ring1][C][#N][C][=N][N][Ring1][#Branch1][C][C][O][C][Ring2][Ring1][Ring2]
|
C[C@H](CS(C)(=O)=O)C3=O.N13C[C@@H]2CC[C@@]26C1.c15c(C#N)cnn17.C46=O.C7CO.N45
|
CC1(C)C[C@](O)(CC(=O)N2CC3(C2)CN(C(=O)C2(C4CCCCC4)CC2)C3)CO1
|
CCC)C[C@]O)CC=O)NCCC4)CNC=O)CCCCCCC6))))))CC3))))C4))))))))CO5
|
[C][C][Branch1][C][C][C][C@][Branch1][C][O][Branch2][Ring2][=Branch2][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch2][C][Ring1][S][C][O][Ring2][Ring1][N]
|
C17(C2CCCCC2)CC1.CC1(C)C[C@@]8(O)CO1.N15CC2(C1)CN6C2.C8C5=O.C67=O
|
CN(CCCN(C)C(=O)c1cnn2ccsc12)C(=O)Cc1ccc([S@@+](C)[O-])cc1
|
CNCCCNC)C=O)ccnnccsc85)))))))))))))C=O)Ccccc[S@@+]C)[O-]))cc6
|
[C][N][Branch2][Ring1][Branch2][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=N][N][C][=C][S][C][=Ring1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][=Branch1][S@@+1][Branch1][C][C][O-1][C][=C][Ring1][=Branch2]
|
c18ccc([S@@+](C)[O-])cc1.c17cnn2ccsc12.C5CC6.C4(=O)C8.CN45.N36C.C37=O
|
C[C@@H](C(=O)N[C@H]1CN(C(=O)C(F)(F)CC2CC2)CCC12CCC2)N1CCSCC1
|
C[C@@H]C=O)N[C@H]CNC=O)CF)F)CCCC3))))))CCC6CCC4)))))))))))NCCSCC6
|
[C][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][C][C][C][Ring1][Ring1][C][C][C][Ring1][#C][C][C][C][Ring1][Ring2][N][C][C][S][C][C][Ring1][=Branch1]
|
[C@H]16CN4CCC12CCC2.C4(=O)C(F)(F)C7.N15CCSCC1.C[C@H]5C3=O.C17CC1.N36
|
O=C(Cn1cc(Br)cn1)N[C@@H]1C[C@@H](NC(=O)[C@H]2C[C@@](F)(CO)C2)C12CCC2
|
O=CCnccBr)cn5))))))N[C@@H]C[C@@H]NC=O)[C@H]C[C@@]F)CO))C4))))))C4CCC4
|
[O][=C][Branch1][N][C][N][C][=C][Branch1][C][Br][C][=N][Ring1][=Branch1][N][C@@H1][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C@@][Branch1][C][F][Branch1][Ring1][C][O][C][Ring1][#Branch1][C][Ring1][=C][C][C][C][Ring1][Ring2]
|
[C@@H]15C[C@@H]6C12CCC2.n18cc(Br)cn1.[C@H]17C[C@]9(F)C1.O=C3C8.C47=O.N35.N46.C9O
|
C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2C)CCCN1C(=O)[C@@H]1[C@@H]2CC[C@@]1(c1cscn1)C2
|
C[C@@H]CNC=O)[C@H]C[C@@H]3C)))))CCCN7C=O)[C@@H][C@@H]CC[C@@]5ccscn5)))))C5
|
[C][C@@H1][C][N][Branch1][O][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][C][N][Ring1][=N][C][=Branch1][C][=O][C@@H1][C@@H1][C][C][C@@][Ring1][Branch1][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][C][Ring1][#Branch2]
|
C[C@@H]1CN3CCCN14.[C@@H]16[C@@H]2CC[C@@]17C2.c17cscn1.[C@H]15C[C@@H]1C.C35=O.C46=O
|
CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]1C(=O)Nc1ccc2cc(C)[nH]c2c1
|
CCC[C@@H]NCC)=O)))C=O)NCC[C@H]4C=O)NccccccC)[nH]c5c9
|
[C][C][C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][N][C][C][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Branch1][C][C][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2]
|
c17ccc2cc(C)[nH]c2c1.CCC[C@@H]6C4=O.N14CC[C@H]18.C3(C)=O.C58=O.N36.N57
|
O=C(Cn1nccn1)Nc1cccc(C(=O)N=c2[nH][nH]c3c(Cl)cccc23)c1
|
O=CCnnccn5))))))NcccccC=O)N=c[nH][nH]ccCl)cccc96)))))))))))c6
|
[O][=C][Branch1][=Branch2][C][N][N][=C][C][=N][Ring1][Branch1][N][C][=C][C][=C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][=C][NH1][NH1][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][=C][Ring2][Ring1][Ring1]
|
C6(=O)N=c1[nH][nH]c2c(Cl)cccc12.c15cccc6c1.n17nccn1.O=C4C7.N45
|
O=C(NCC1CC1)C(=O)N[C@@]12CCCC[C@@H]1CN(C(=O)CC1(O)CCCCC1)C2
|
O=CNCCCC3)))))C=O)N[C@@]CCCC[C@@H]6CNC=O)CCO)CCCCC6))))))))C9
|
[O][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C@@][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
[C@@]127CCCC[C@@H]1CN5C2.C19(O)CCCCC1.O=C3C4=O.C5(=O)C9.C18CC1.N36.C68.N47
|
CC[C@H]1C[C@@H]1CNC(=O)C1(CCNC(=O)C(C)(C)CC(C)(C)C)CC1
|
CC[C@H]C[C@@H]3CNC=O)CCCNC=O)CC)C)CCC)C)C))))))))CC3
|
[C][C][C@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][S]
|
C3(=O)C(C)(C)CC(C)(C)C.[C@H]17C[C@@H]18.C169CC1.C26=O.C9C5.CC7.C48.N24.N35
|
CCSC[C@H](NC(=O)c1cocn1)C(=O)N[C@H](C)c1ccnc(C)n1
|
CCSC[C@H]NC=O)ccocn5)))))))C=O)N[C@H]C)cccncC)n6
|
[C][C][S][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][O][C][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=C][C][=N][C][Branch1][C][C][=N][Ring1][#Branch1]
|
c19ccnc(C)n1.C7[C@H]4C3=O.c18cocn1.C28=O.[C@H]59C.CC6.S67.N24.N35
|
CN(CC(C)(C)NC(=O)c1n[nH]c2c1CCCC2)C(=O)c1cccc(Cl)c1F
|
CNCCC)C)NC=O)cn[nH]cc5CCCC6)))))))))))))C=O)cccccCl)c6F
|
[C][N][Branch2][Ring1][O][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F]
|
c17n[nH]c2c1CCCC2.c18cccc(Cl)c1F.C5C6(C)C.CN45.C37=O.C48=O.N36
|
C[C@H]1CCC=C1C(=O)N1CCN(C)C[C@@H]1CNC(=O)c1ccc2cccnc2n1
|
C[C@H]CCC=C5C=O)NCCNC)C[C@@H]6CNC=O)cccccccnc6n%10
|
[C][C@H1][C][C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][C@@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][C][Ring1][=Branch1][=N][Ring1][#Branch2]
|
c16ccc2cccnc2n1.C[C@H]1CCC=C1C3=O.N13CCN(C)C[C@@H]17.C46=O.C57.N45
|
O=C(CCOc1cccnc1)NCCCNC(=O)CC12CCC(CC1)CC2
|
O=CCCOccccnc6)))))))))NCCCNC=O)CCCCCCC6))CC6
|
[O][=C][Branch1][N][C][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch2]
|
C129CCC(CC1)CC2.c16cccnc1.O=C3CC5.C7CC8.C4(=O)C9.O56.N37.N48
|
O=C(NCc1c(F)cncc1F)[C@H]1CCCN1C(=O)CNc1cccnc1
|
O=CNCccF)cncc6F)))))))))[C@H]CCCN5C=O)CNccccnc6
|
[O][=C][Branch1][#C][N][C][C][=C][Branch1][C][F][C][=N][C][=C][Ring1][#Branch1][F][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
c18c(F)cncc1F.[C@H]17CCCN13.c16cccnc1.C3(=O)C5.O=C27.N24.C48.N56
|
Cc1c(Br)cc(C(=O)N2CCN(C(=O)c3ccc(Br)c(F)c3C)C[C@H]2C)cc1Br
|
CccBr)ccC=O)NCCNC=O)ccccBr)cF)c6C))))))))C[C@H]6C))))))))cc6Br
|
[C][C][=C][Branch1][C][Br][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][F][=C][Ring1][Branch2][C][C][C@H1][Ring1][P][C][C][=C][Ring2][Ring1][O][Br]
|
Cc1c(Br)cc6cc1Br.c17ccc(Br)c(F)c1C.N14CCN5C[C@H]1C.C46=O.C57=O
|
CC(=O)Nc1ccc(C(=O)N[C@]2(C)C[C@@H](NC(=O)C3=C(Cl)CC3)C2)cc1F
|
CC=O)NccccC=O)N[C@]C)C[C@@H]NC=O)C=CCl)CC4))))))C4))))))cc6F
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][C][Ring1][Branch1][C][Ring1][=N][C][=C][Ring2][Ring1][=Branch1][F]
|
c18ccc%10cc1F.C6(=O)C1=C(Cl)CC1.[C@]17(C)C[C@H]9C1.CC4=O.C5%10=O.N48.N57.N69
|
CCn1cnnc1C(=O)N1C[C@@H](NC(=O)CCc2nc(C(C)(C)C)no2)C[C@H]1C
|
CCncnnc5C=O)NC[C@@H]NC=O)CCcncCC)C)C))no5)))))))))C[C@H]5C
|
[C][C][N][C][=N][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][C][C][=N][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][O][Ring1][=Branch2][C][C@H1][Ring2][Ring1][Ring1][C]
|
N13C[C@@H]5C[C@H]1C.n17cnnc16.c18nc9no1.C4(=O)CC8.C9(C)(C)C.C36=O.CC7.N45
|
O=C(NCCCCl)N1CC(CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1
|
O=CNCCCCl)))))NCCCNS=O)=O)Ccccc[N+]=O)[O-]))cc6))))))))))C4
|
[O][=C][Branch1][=Branch1][N][C][C][C][Cl][N][C][C][Branch2][Ring1][#Branch2][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][Ring2][Ring1][Ring1]
|
c19ccc([N+](=O)[O-])cc1.N14CC8C1.S7(=O)(=O)C9.C5CCCl.O=C34.N35.C68.N67
|
C[C@H](CC(=O)N1CCSC[C@@H]1C(=O)NC12CCCN(CCC1)C2)N(C)C
|
C[C@H]CC=O)NCCSC[C@@H]6C=O)NCCCCNCCC8)))C6))))))))))))))))NC)C
|
[C][C@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C][S][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Branch2][C][Ring1][=Branch2][N][Branch1][C][C][C]
|
C126CCCN(CCC1)C2.N13CCSC[C@@H]17.C[C@@H]5CC3=O.C47=O.N5(C)C.N46
|
O=C(NCCn1cc(I)cn1)C(=O)N1CCc2c(Cl)cccc2C1
|
O=CNCCnccI)cn5))))))))C=O)NCCccCl)cccc6C%10
|
[O][=C][Branch1][=C][N][C][C][N][C][=C][Branch1][C][I][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][C][Ring1][O]
|
N14CCc2c(Cl)cccc2C1.n16cc(I)cn1.O=C3C4=O.C5C6.N35
|
Cn1cncc1C(=O)N1C[C@H](NC(=O)Cc2ccc(Br)nc2)CC(F)(F)C1
|
Cncncc5C=O)NC[C@H]NC=O)CccccBr)nc6)))))))))CCF)F)C6
|
[C][N][C][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Br][N][=C][Ring1][#Branch1][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][Ring1]
|
N13C[C@H]5CC(F)(F)C1.c17ccc(Br)nc1.Cn1cncc16.C4(=O)C7.C36=O.N45
|
O=C(Nc1cnc(O)c2ccccc12)c1cc2cc(O)ccc2[nH]1
|
O=CNccncO)cccccc%106)))))))))))cccccO)ccc6[nH]9
|
[O][=C][Branch2][Ring1][Ring1][N][C][=C][N][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1][C][=C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2]
|
c14cnc(O)c2ccccc12.c15cc2cc(O)ccc2[nH]1.O=C35.N34
|
CC(C)N(CCC(=O)N1CC[S@+]([O-])C[C@@H]1C)C(=O)[C@@H]1CCOC1(C)C
|
CCC)NCCC=O)NCC[S@+][O-])C[C@@H]6C))))))))))C=O)[C@@H]CCOC5C)C
|
[C][C][Branch1][C][C][N][Branch2][Ring1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][S@+1][Branch1][C][O-1][C][C@@H1][Ring1][#Branch1][C][C][=Branch1][C][=O][C@@H1][C][C][O][C][Ring1][Branch1][Branch1][C][C][C]
|
N12CC[S@+]([O-])C[C@@H]1C.[C@@H]16CCOC1(C)C.C5CC2=O.CC4C.N345.C36=O
|
C[C@@H]1CC[C@@H](N=c2cc(NCCCc3nncs3)nc(C(F)(F)F)[nH]2)C1
|
C[C@@H]CC[C@@H]N=cccNCCCcnncs5)))))))))ncCF)F)F))[nH]6)))))))C5
|
[C][C@@H1][C][C][C@@H1][Branch2][Ring2][C][N][=C][C][=C][Branch1][N][N][C][C][C][C][=N][N][=C][S][Ring1][Branch1][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][NH1][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch2]
|
C[C@@H]1CC[C@@H](N=c2cc5nc7[nH]2)C1.c16nncs1.C4CC6.C7(F)(F)F.N45
|
C[C@H](C(=O)N[C@@H]1CC(F)(F)C[C@@H]1NC(=O)CC1=NNC(=O)C1)N1CCCCCC1
|
C[C@H]C=O)N[C@@H]CCF)F)C[C@@H]5NC=O)CC=NNC=O)C5)))))))))))))))NCCCCCC7
|
[C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][C][C][Branch1][C][F][Branch1][C][F][C][C@@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=N][N][C][=Branch1][C][=O][C][Ring1][=Branch1][N][C][C][C][C][C][C][Ring1][#Branch1]
|
C3(=O)CC1=NNC(=O)C1.[C@@H]15CC(F)(F)C[C@@H]16.N14CCCCCC1.C[C@@H]4C2=O.N25.N36
|
C#CC[C@@]1(C(=O)N2CC=C(C(=O)N3CC(CCCCC)C3)CC2)CCCO1
|
C#CC[C@@]C=O)NCC=CC=O)NCCCCCCC)))))C4)))))CC6)))))))CCCO5
|
[C][#C][C][C@@][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][C][C][C][C][C][C][Ring1][=Branch2][C][C][Ring1][P][C][C][C][O][Ring2][Ring1][Branch2]
|
N14CC=C(C5=O)CC1.[C@@]167CCCO1.N15CC8C1.C8CCCC.C#CC7.C46=O
|
CO[C@@H](CNC(=O)[C@@H](C)CC(C)C)CC(=O)N1CCCNC(=O)CC1
|
CO[C@@H]CNC=O)[C@@H]C)CCC)C)))))))CC=O)NCCCNC=O)CC8
|
[C][O][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][C][Ring1][=Branch2]
|
N13CCCNC(=O)CC1.C2(=O)[C@@H](C)CC(C)C.[C@H]4(C5)CC3=O.CO4.N25
|
C[C@H](O)CN(CCNC(=O)c1cscc1Cl)C(=O)[C@@H]1C[C@H]1C1CCOCC1
|
C[C@H]O)CNCCNC=O)ccscc5Cl))))))))))C=O)[C@@H]C[C@H]3CCCOCC6
|
[C][C@H1][Branch1][C][O][C][N][Branch1][S][C][C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][Cl][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][C][C][O][C][C][Ring1][=Branch1]
|
[C@@H]17C[C@H]1C1CCOCC1.c18cscc1Cl.C[C@H](O)C4.N345.C5C6.C28=O.C37=O.N26
|
CCC[C@H](OCC)C(=O)N1C[C@H]2CCC[C@@]2(C(=O)N2CC(OC(=O)NC)C2)C1
|
CCC[C@H]OCC)))C=O)NC[C@H]CCC[C@@]5C=O)NCCOC=O)NC))))C4)))))C8
|
[C][C][C][C@H1][Branch1][Ring2][O][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@][Ring1][Branch1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][O][C][=Branch1][C][=O][N][C][C][Ring1][=Branch2][C][Ring2][Ring1][Ring1]
|
N14C[C@H]2CCC[C@@]2%10C1.CCC[C@H]7C4=O.N15CC9C1.C5%10=O.C36=O.O78.C8C.O39.N6C
|
Cc1nc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(C(=O)CSCC#N)C3)[nH]c1C
|
CcncC=O)N[C@@H]C[C@H]C[C@@H]C6)NC=O)CSCC#N))))))C5)))))))))[nH]c5C
|
[C][C][N][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][N][Branch1][#Branch2][C][=Branch1][C][=O][C][S][C][C][#N][C][Ring1][=N][NH1][C][=Ring2][Ring1][#Branch1][C]
|
[C@@H]18C[C@H]2C[C@@H](C1)N5C2.Cc1nc9[nH]c1C.C5(=O)C6.C49=O.C7C#N.N48.S67
|
CCCCCC[C@@H](C)CC(=O)N(CCN(C)C(=O)[C@@H](O)CC(F)(F)F)C(C)C
|
CCCCCC[C@@H]C)CC=O)NCCNC)C=O)[C@@H]O)CCF)F)F))))))))CC)C
|
[C][C][C][C][C][C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch2][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][C][C]
|
CCCCCC[C@@H](C)CC1=O.C2(=O)[C@@H](O)CC(F)(F)F.N135.C3C4.N24C.C5(C)C
|
C[C@@H](SCc1ccccc1)C(=O)N1CC[C@@H](CCNc2ncc(C#N)cc2F)C1
|
C[C@@H]SCcccccc6))))))))C=O)NCC[C@@H]CCNcnccC#N))cc6F))))))))))C5
|
[C][C@@H1][Branch1][O][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][P][C][C][N][C][=N][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][F][C][Ring1][P]
|
c17ncc(C#N)cc1F.c19ccccc1.N13CC[C@@H]8C1.C[C@@H]5C3=O.C8C4.S56.C69.N47
|
CCc1ccc(C(=O)N2CCN(C(=O)[C@@H](O)C3CC3)C[C@@H]2CC(F)(F)F)cc1F
|
CCccccC=O)NCCNC=O)[C@@H]O)CCC3)))))C[C@@H]6CCF)F)F))))))))))cc6F
|
[C][C][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][Ring1][Ring1][C][C@@H1][Ring1][=N][C][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring2][Ring1][#Branch2][F]
|
c19ccc6cc1F.N14CCN5C[C@@H]17.C5(=O)[C@H]8O.C7C(F)(F)F.C46=O.C18CC1.CC9
|
CCC[C@@H](C(=O)N1CC[C@H]2CN(C(=O)c3cn4ccc(C)cc4n3)[C@H]2C1)C(C)C
|
CCC[C@@H]C=O)NCC[C@H]CNC=O)ccncccC)cc6n9))))))))))[C@H]4C8)))))))))CC)C
|
[C][C][C][C@@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][C][=C][C][Branch1][C][C][=C][C][Ring1][#Branch1][=N][Ring1][#Branch2][C@H1][Ring1][S][C][Ring2][Ring1][Ring2][C][Branch1][C][C][C]
|
c17cn2ccc(C)cc2n1.CCC[C@@H](C5=O)C(C)C.N15CC[C@H]2CN6[C@H]2C1.C67=O
|
CCOC(=O)c1nnc(NC(=O)[C@@]2(C)CCN2c2ncnc3[nH]ccc23)s1
|
CCOC=O)cnncNC=O)[C@@]C)CCN4cncnc[nH]ccc95)))))))))))))))s5
|
[C][C][O][C][=Branch1][C][=O][C][=N][N][=C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][N][Ring1][Branch1][C][=N][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][S][Ring2][Ring1][=Branch1]
|
c18ncnc2[nH]ccc12.c1%10nnc7s1.[C@]19(C)CCN18.C4%10=O.C59=O.CC6.O46.N57
|
C=C[C@H](CC)C(=O)N1CCC[C@@H]1CCC(=O)N1CCOCC(C)(C)C1
|
C=C[C@H]CC))C=O)NCCC[C@@H]5CCC=O)NCCOCCC)C)C7
|
[C][=C][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch2]
|
N13CCOCC(C)(C)C1.C=C[C@H](CC)C2=O.N12CCC[C@@H]14.C4CC3=O
|
CCCN1CCC[C@@H]1C(=O)N(CCNC(=O)c1ccn(C)c1)C1CC1
|
CCCNCCC[C@@H]5C=O)NCCNC=O)cccnC)c5)))))))))CCC3
|
[C][C][C][N][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
N14CCC[C@@H]18.c19ccn(C)c1.CCC4.C28=O.N257.C5C6.C39=O.C17CC1.N36
|
O=C(N[C@H]1CC[C@@H](CNC(=O)C2(F)CCCC2)C1)c1cnc(CC2CC2)nc1O
|
O=CN[C@H]CC[C@@H]CNC=O)CF)CCCC5))))))))C5))))))ccncCCCC3))))nc6O
|
[O][=C][Branch2][Ring1][O][N][C@H1][C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][Branch1][C][F][C][C][C][C][Ring1][=Branch1][C][Ring1][#C][C][=C][N][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][=C][Ring1][#Branch2][O]
|
c18cnc9nc1O.[C@H]16CC[C@@H]%10C1.C17(F)CCCC1.O=C38.C47=O.C1%11CC1.N36.C5%10.N45.C9%11
|
C=C[C@](C)(CC)C(=O)NCCC1(NC(=O)[C@@H](CC)C2(O)CCCCC2)CC1
|
C=C[C@]C)CC))C=O)NCCCNC=O)[C@@H]CC))CO)CCCCC6)))))))))CC3
|
[C][=C][C@][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][C][C][Branch1][C][O][C][C][C][C][C][Ring1][#Branch1][C][C][Ring1][S]
|
C=C[C@](C)(CC)C3=O.C18(O)CCCCC1.C4(=O)[C@H]8CC.C167CC1.C5C7.N35.N46
|
C[C@H](CNC(=O)c1cn[nH]c1)CNC(=O)[C@@H](O)Cc1ccc(Cl)cc1
|
C[C@H]CNC=O)ccn[nH]c5))))))))CNC=O)[C@@H]O)CccccCl)cc6
|
[C][C@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][C][=N][NH1][C][=Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
c17ccc(Cl)cc1.C3(=O)[C@@H](O)C7.C[C@H](C4)C5.c16cn[nH]c1.C26=O.N24.N35
|
CCOCCCNC(=O)C(=O)N[C@H]1CCN(C(=O)OCc2ccccc2)C1
|
CCOCCCNC=O)C=O)N[C@H]CCNC=O)OCcccccc6)))))))))C5
|
[C][C][O][C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#C]
|
[C@H]1%12CCN7C1.c14ccccc1.C5(=O)C6=O.C9CC%11.C37=O.CC8.O89.N5%11.N6%12.O3%10.C%104
|
COCCSCCNC(=O)C1(NC(=O)[C@@H]2C[C@H](O)[C@@H](F)C2)CC(F)C1
|
COCCSCCNC=O)CNC=O)[C@@H]C[C@H]O)[C@@H]F)C5)))))))CCF)C4
|
[C][O][C][C][S][C][C][N][C][=Branch1][C][=O][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][F][C][Ring1][#Branch1][C][C][Branch1][C][F][C][Ring1][#C]
|
[C@@H]1%11C[C@H](O)[C@@H](F)C1.C17%10CC(F)C1.C5C8.C9C6.C3%10=O.C4%11=O.CO5.S89.N36.N47
|
CCc1cc(C(=O)N[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C2)no1
|
CCcccC=O)N[C@@H]CCNC=O)CCC=O)NNC)C)))))))C5)))))))no5
|
[C][C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][N][Branch1][C][C][C][C][Ring1][#C][=N][O][Ring2][Ring1][#Branch1]
|
C4(=O)CCC(=O)NN(C)C.c17cc6no1.[C@@H]15CCN4C1.C36=O.CC7.N35
|
CC1(CC(=O)N2CCc3c(Cl)ccc(Br)c3C2)CCCCCC1
|
CCCC=O)NCCccCl)cccBr)c6C%10))))))))))))CCCCCC7
|
[C][C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][C][C][C][=C][Branch1][C][Cl][C][=C][C][Branch1][C][Br][=C][Ring1][Branch2][C][Ring1][N][C][C][C][C][C][C][Ring2][Ring1][=Branch1]
|
N14CCc2c(Cl)ccc(Br)c2C1.CC15CCCCCC1.C5C4=O
|
COC(=O)c1cc(C(=O)N2CC[C@H](CCNC(=O)[C@@H]3C[C@H]3c3cnc[nH]3)C2)ns1
|
COC=O)cccC=O)NCC[C@H]CCNC=O)[C@@H]C[C@H]3ccnc[nH]5))))))))))))C5))))))ns5
|
[C][O][C][=Branch1][C][=O][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][=C][N][=C][NH1][Ring1][Branch1][C][Ring2][Ring1][C][=N][S][Ring2][Ring1][=Branch2]
|
c18cc9ns1.N15CC[C@H]%11C1.c1%12cnc[nH]1.[C@@H]1%10C[C@H]1%12.C48=O.C59=O.C%11C7.C6%10=O.CO4.N67
|
CCc1ccc(C(=O)N2CCC[C@@]23CCN(C(=O)c2cc(C)cnc2OC)C3)o1
|
CCccccC=O)NCCC[C@@]5CCNC=O)cccC)cnc6OC)))))))))C5))))))))))o5
|
[C][C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][C@@][Ring1][Branch1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][N][=C][Ring1][#Branch1][O][C][C][Ring1][S][O][Ring2][Ring1][O]
|
N14CCC[C@@]12CCN5C2.c18cc(C)cnc16.c19ccc7o1.C47=O.C58=O.CC9.O6C
|
Cn1cc(CNC(=O)C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)c(O)nc1=O
|
CnccCNC=O)C=O)NCC[C@H]ccccCl)cc6))))))C5)))))))))cO)nc6=O
|
[C][N][C][=C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Ring1][N][C][Branch1][C][O][=N][C][Ring2][Ring1][=Branch2][=O]
|
Cn1cc7c(O)nc1=O.c18ccc(Cl)cc1.N15CC[C@H]8C1.C4(=O)C5=O.C67.N46
|
COc1cc(Cl)cc(C(=O)N[C@H](C)CNC(=O)CCOCC(C)C)c1
|
COcccCl)ccC=O)N[C@H]C)CNC=O)CCOCCC)C))))))))))))c6
|
[C][O][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][O][C][C][Branch1][C][C][C][=C][Ring2][Ring1][#Branch1]
|
c16cc9cc(Cl)c1.C3(=O)CC4.[C@@H]7(C)C8.C5C(C)C.C29=O.CO6.N27.N38.O45
|
O=C(/C=C/C1CCCCC1)N1CCC[C@@]2(CCCN2C(=O)CC2(O)CC2)C1
|
O=C/C=C/CCCCCC6))))))))NCCC[C@@]CCCN5C=O)CCO)CC3)))))))))C6
|
[O][=C][Branch1][O][/C][=C][/C][C][C][C][C][C][Ring1][=Branch1][N][C][C][C][C@@][Branch2][Ring1][Ring2][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][Ring1][Ring2][C][Ring1][P]
|
N13CCC[C@@]2(CCCN24)C1.C=5C1CCCCC1.O=C3C=5.C4(=O)C6.C16(O)CC1
|
COC1(C(=O)NC[C@@]2(F)CCCN(C(=O)CN3CCCCCC3)CC2)CCCC1
|
COCC=O)NC[C@@]F)CCCNC=O)CNCCCCCC7)))))))))CC7))))))))))CCCC5
|
[C][O][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@][Branch1][C][F][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][C][C][C][C][C][Ring1][#Branch1][C][C][Ring2][Ring1][C][C][C][C][C][Ring2][Ring1][O]
|
[C@]1%10(F)CCCN5CC1.N18CCCCCC1.C169CCCC1.C5(=O)C8.C49=O.CO6.N47.C7%10
|
CCCSCCC(=O)N1CCN(C(=O)CCN2CCC[C@@H](N(C)C)C2)[C@@H](CC)C1
|
CCCSCCC=O)NCCNC=O)CCNCCC[C@@H]NC)C))C6)))))))))[C@@H]CC))C6
|
[C][C][C][S][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][N][C][C][C][C@@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][=Branch2][C@@H1][Branch1][Ring1][C][C][C][Ring2][Ring1][Branch1]
|
N13CCN4[C@@H]9C1.N15CCC[C@@H]8C1.C7CC3=O.C4(=O)CC5.CCC6.N8(C)C.S67.C9C
|
O=C(N[C@H]1CC[C@@H](O)CN(C(=O)C[C@H]2CCCOC2)C1)c1cccn2nccc12
|
O=CN[C@H]CC[C@@H]O)CNC=O)C[C@H]CCCOC6))))))))C7))))))))ccccnnccc95
|
[O][=C][Branch2][Ring1][=N][N][C@H1][C][C][C@@H1][Branch1][C][O][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][P][C][=C][C][=C][N][N][=C][C][=C][Ring1][=Branch2][Ring1][Branch1]
|
[C@H]15CC[C@@H](O)CN4C1.c16cccn2nccc12.[C@H]17CCCOC1.C4(=O)C7.O=C36.N35
|
C[C@H]1C[C@@H](O)CN1C(=O)[C@@H]1C[C@@H]1C(=O)N=c1cc(Cl)n(C)[nH]1
|
C[C@H]C[C@@H]O)CN5C=O)[C@@H]C[C@@H]3C=O)N=cccCl)nC)[nH]5
|
[C][C@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][=C][C][=C][Branch1][C][Cl][N][Branch1][C][C][NH1][Ring1][#Branch1]
|
C4(=O)N=c1cc(Cl)n(C)[nH]1.C[C@H]1C[C@@H](O)CN12.[C@@H]13C[C@@H]14.C23=O
|
C[C@@H]1C[C@H](NC(=O)c2ccnc3ccc(N)cc23)CN1C(=O)C[C@]1(C)CC1(Cl)Cl
|
C[C@@H]C[C@H]NC=O)cccnccccN)cc%106))))))))))))CN5C=O)C[C@]C)CC3Cl)Cl
|
[C][C@@H1][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][O][Ring1][#Branch1][C][N][Ring2][Ring1][Ring1][C][=Branch1][C][=O][C][C@][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][Cl][Cl]
|
c17ccnc2ccc(N)cc12.C[C@@H]1C[C@H]6CN15.[C@@]18(C)CC1(Cl)Cl.C5(=O)C8.C47=O.N46
|
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