SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCCC[C@H](O)C(=O)N[C@@H]1CCCN(C(=O)c2ccc(Cl)nn2)CC1
|
CCCC[C@H]O)C=O)N[C@@H]CCCNC=O)ccccCl)nn6)))))))CC7
|
[C][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][N][=N][Ring1][#Branch1][C][C][Ring1][S]
|
CCCC[C@H](O)C3=O.[C@@H]15CCCN4CC1.c16ccc(Cl)nn1.C46=O.N35
|
COC(=O)[C@H](NC(=O)c1cccnc1CNC(=O)[C@@H]1C[C@@H](C)CO1)C(C)C
|
COC=O)[C@H]NC=O)ccccnc6CNC=O)[C@@H]C[C@@H]C)CO5))))))))))))))))CC)C
|
[C][O][C][=Branch1][C][=O][C@H1][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][C][C][O][Ring1][=Branch1][C][Branch1][C][C][C]
|
C2(=O)[C@H]5C(C)C.c18cccnc19.[C@@H]17C[C@@H](C)CO1.C38=O.C47=O.CO2.N35.C69.N46
|
CC1(C#N)CCN(C(=O)Cn2ccc(=NCc3ccnc(F)c3)nc2O)CC1
|
CCC#N))CCNC=O)Cnccc=NCcccncF)c6))))))))nc6O)))))))))CC6
|
[C][C][Branch1][Ring1][C][#N][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C][N][C][=C][C][=Branch1][=C][=N][C][C][=C][C][=N][C][Branch1][C][F][=C][Ring1][#Branch1][N][=C][Ring1][#C][O][C][C][Ring2][Ring1][O]
|
n15ccc(=NC6)nc1O.CC1(C#N)CCN4CC1.c16ccnc(F)c1.C4(=O)C5
|
COC[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(C)(C)NC(=O)c1cnc(C2CC2)o1
|
COC[C@@H]CCC)C)))C=O)NCCC[C@H]5CC)C)NC=O)ccncCCC3)))o5
|
[C][O][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2]
|
C5[C@@H](CC(C)C)C3=O.N13CCC[C@H]18.c17cnc9o1.C68(C)C.C47=O.C19CC1.CO5.N46
|
CC(C)(F)CCC(=O)N1CC[C@@]1(C)CC(=O)NC12CC(F)(C1)C2
|
CCC)F)CCC=O)NCC[C@@]4C)CC=O)NCCCF)C4)C4
|
[C][C][Branch1][C][C][Branch1][C][F][C][C][C][=Branch1][C][=O][N][C][C][C@@][Ring1][Ring2][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][=Branch1]
|
CC(C)(F)CCC3=O.N13CC[C@]16C.C125CC(F)(C1)C2.C6C4=O.N45
|
C=C[C@H]1CN(C(=O)c2ncsc2C)C[C@H]1NC(=O)CCCOC
|
C=C[C@H]CNC=O)cncsc5C)))))))C[C@H]5NC=O)CCCOC
|
[C][=C][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][=C][S][C][=Ring1][Branch1][C][C][C@H1][Ring1][=N][N][C][=Branch1][C][=O][C][C][C][O][C]
|
C=C[C@H]1CN3C[C@H]16.c17ncsc1C.C4(=O)CCC5.C37=O.N46.O5C
|
CSc1nn(C)cc1C(=O)NC[C@@H]1COCCN1C(=O)[C@]12COC[C@H]1C2(F)F
|
CScnnC)cc5C=O)NC[C@@H]COCCN6C=O)[C@]COC[C@H]5C6F)F
|
[C][S][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@][C][O][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][Branch1][C][F][F]
|
[C@]126COC[C@H]1C2(F)F.c19nn(C)cc17.[C@@H]18COCCN14.C37=O.C46=O.CS9.N35.C58
|
CN1CC[C@H](CC(=O)N[C@@H]2CC[C@H]2CNC(=O)C2(CO)CC(F)(F)C2)C1=O
|
CNCC[C@H]CC=O)N[C@@H]CC[C@H]4CNC=O)CCO))CCF)F)C4))))))))))))))C5=O
|
[C][N][C][C][C@H1][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2][C][Ring2][Ring1][=Branch2][=O]
|
CN1CC[C@H]8C1=O.C17%10CC(F)(F)C1.[C@@H]16CC[C@H]19.C8C3=O.C47=O.N36.C59.N45.C%10O
|
O=C(COC(=O)CO)NC[C@H]1CN(C(=O)C[C@@H]2CCC[C@@H](O)C2)C[C@@]1(F)CO
|
O=CCOC=O)CO)))))NC[C@H]CNC=O)C[C@@H]CCC[C@@H]O)C6))))))))C[C@@]5F)CO
|
[O][=C][Branch1][=Branch2][C][O][C][=Branch1][C][=O][C][O][N][C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C@@H1][C][C][C][C@@H1][Branch1][C][O][C][Ring1][#Branch1][C][C@@][Ring1][#C][Branch1][C][F][C][O]
|
[C@H]18CN5C[C@]1%10F.[C@@H]19CCC[C@@H](O)C1.O=C4C6.C3(=O)CO.C5(=O)C9.O36.N47.C78.C%10O
|
CN(Cc1ccsc1Br)[C@H](C(=O)Nc1ccc(F)cc1)c1ccsc1Br
|
CNCcccsc5Br)))))))[C@H]C=O)NccccF)cc6))))))))cccsc5Br
|
[C][N][Branch1][#Branch2][C][C][C][=C][S][C][=Ring1][Branch1][Br][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][=C][S][C][=Ring1][Branch1][Br]
|
c15ccc(F)cc1.c16ccsc1Br.c17ccsc1Br.[C@H]47C2=O.CN34.C36.N25
|
O=C(C=Cc1ccccc1)NCC1(NC(=O)Cc2ccccc2F)CCC1
|
O=CC=Ccccccc6))))))))NCCNC=O)Ccccccc6F))))))))))CCC4
|
[O][=C][Branch1][O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][S][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][C][Ring1][#C]
|
C=7c1ccccc1.c19ccccc1F.C168CCC1.O=C3C=7.C4(=O)C9.N35.C58.N46
|
CN(Cc1cn(Cc2ccc(-n3cccn3)cn2)nn1)C1CCCCC1
|
CNCccnCcccc-ncccn5)))))cn6)))))))nn5))))))CCCCCC6
|
[C][N][Branch2][Ring1][=C][C][C][=C][N][Branch2][Ring1][Ring1][C][C][=C][C][=C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][C][=N][Ring1][O][N][=N][Ring1][P][C][C][C][C][C][C][Ring1][=Branch1]
|
c18ccc9cn1.c17cn6nn1.C15CCCCC1.n19cccn1.CN45.C47.C68
|
CCC[C@H](O)CC(=O)N1C[C@@H](NC(=O)C(C)(C)c2ccc(F)cc2)[C@H](C2CC2)C1
|
CCC[C@H]O)CC=O)NC[C@@H]NC=O)CC)C)ccccF)cc6)))))))))[C@H]CCC3)))C5
|
[C][C][C][C@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Branch1]
|
N13C[C@@H]5[C@H](C2CC2)C1.CCC[C@H](O)CC3=O.c16ccc(F)cc1.C4(=O)C6(C)C.N45
|
NCc1cn(CCCCCCC(=O)N2CCc3c(F)cccc3C2)nn1
|
NCccnCCCCCCC=O)NCCccF)cccc6C%10)))))))))))))))))nn5
|
[N][C][C][=C][N][Branch2][Ring1][N][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][Ring1][O][N][=N][Ring2][Ring1][Branch2]
|
N14CCc2c(F)cccc2C1.C5CCCCCC4=O.c16cn5nn1.NC6
|
CCc1nc(C(=O)N2C[C@H](C)CN(C(=O)c3cccc4c3CCO4)C[C@H]2C)cs1
|
CCcncC=O)NC[C@H]C)CNC=O)cccccc6CCO5))))))))))C[C@H]7C)))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][O][Ring1][Branch1][C][C@H1][Ring2][Ring1][Ring1][C][=C][S][Ring2][Ring1][O]
|
N15C[C@H](C)CN6C[C@H]1C.c18cccc2c1CCO2.c19nc7cs1.C57=O.C68=O.CC9
|
COC(=O)[C@H]1C[C@H](C(=O)NC[C@@H]2CCN2C(=O)[C@@H](C)S(N)(=O)=O)C1
|
COC=O)[C@H]C[C@H]C=O)NC[C@@H]CCN4C=O)[C@@H]C)SN)=O)=O)))))))))))C4
|
[C][O][C][=Branch1][C][=O][C@H1][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C@@H1][Branch1][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][Ring2][Ring1][Ring2]
|
C5(=O)[C@@H](C)S(N)(=O)=O.[C@H]17C[C@H]8C1.[C@@H]19CCN15.C37=O.C48=O.CO3.N46.C69
|
CN1C(=O)C[C@@H](C(=O)NCc2ccc(C(F)(F)F)s2)[C@H]1c1cccs1
|
CNC=O)C[C@@H]C=O)NCccccCF)F)F))s5))))))))[C@H]5ccccs5
|
[C][N][C][=Branch1][C][=O][C][C@@H1][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][S][Ring1][=Branch2][C@H1][Ring2][Ring1][Ring1][C][=C][C][=C][S][Ring1][Branch1]
|
CN1C(=O)C[C@@H]5[C@H]18.c16ccc7s1.c18cccs1.C7(F)(F)F.C35=O.N34.C46
|
CCCC[C@H](O)C(=O)N1CC[C@H](C(=O)Nc2ccc3ccnc(O)c3c2)[C@@H](O)C1
|
CCCC[C@H]O)C=O)NCC[C@H]C=O)NccccccncO)c6c%10))))))))))))[C@@H]O)C6
|
[C][C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][N][=C][Branch1][C][O][C][Ring1][#Branch1][=C][Ring1][O][C@@H1][Branch1][C][O][C][Ring2][Ring1][Branch1]
|
c16ccc2ccnc(O)c2c1.CCCC[C@H](O)C4=O.N14CC[C@H]7[C@@H](O)C1.C57=O.N56
|
CCCC(=O)N1C[C@@H]2CN(C(=O)c3nn(C)cc3I)C[C@@H]2C1
|
CCCC=O)NC[C@@H]CNC=O)cnnC)cc5I)))))))C[C@@H]5C8
|
[C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][I][C][C@@H1][Ring1][=C][C][Ring1][P]
|
N14C[C@@H]2CN5C[C@@H]2C1.c16nn(C)cc1I.CCCC4=O.C56=O
|
CCOc1cc(C(=O)NC[C@H](CCNC(=O)C=C(Cl)Cl)OC)on1
|
CCOcccC=O)NC[C@H]CCNC=O)C=CCl)Cl)))))))OC))))))on5
|
[C][C][O][C][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch1][=C][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][Cl][O][C][O][N][=Ring2][Ring1][Branch1]
|
c16cc9on1.C7[C@@H]5CC8.C3(=O)C=C(Cl)Cl.C29=O.CC4.O46.N27.N38.O5C
|
CSCCCCCC(=O)NCCCC[C@@H](CO)NC(=O)CSCCN(C)C
|
CSCCCCCC=O)NCCCC[C@@H]CO))NC=O)CSCCNC)C
|
[C][S][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][S][C][C][N][Branch1][C][C][C]
|
C6CCCCC1=O.C3CCC[C@H]4CO.C2(=O)C7.C8C5.N5(C)C.CS6.N13.N24.S78
|
C[C@H](CC(=O)N[C@H]1CCS(=O)(=O)C12CN(C(=O)c1ncccc1F)C2)C(C)(C)C
|
C[C@H]CC=O)N[C@H]CCS=O)=O)C5CNC=O)cncccc6F))))))))C4)))))))))))CC)C)C
|
[C][C@H1][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C@H1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][F][C][Ring1][=N][C][Branch1][C][C][Branch1][C][C][C]
|
[C@H]15CCS(=O)(=O)C12CN4C2.C[C@H](CC3=O)C(C)(C)C.c16ncccc1F.C46=O.N35
|
Cc1ccc(N2CCN(C(=NCCC(C)(C)F)N[C@@H]3C[C@H]3C)CC2)cc1
|
CccccNCCNC=NCCCC)C)F)))))N[C@@H]C[C@H]3C))))))CC6))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][C][N][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][N][=N][C][C][C][Branch1][C][C][Branch1][C][C][F][N][C@@H1][C][C@H1][Ring1][Ring1][C][C][C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=Branch2]
|
N14CCN(C(=NCCC(C)(C)F)N5)CC1.Cc1ccc4cc1.[C@@H]15C[C@H]1C
|
O=C(CCC1CC1)NC12CC(CNC(=O)c3cccc(-c4cscn4)c3)(C1)C2
|
O=CCCCCC3)))))NCCCCNC=O)ccccc-ccscn5)))))c6)))))))))C4)C4
|
[O][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Ring1][N][C][C][C][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][=C][Ring1][O][Branch1][Branch1][C][Ring2][Ring1][Ring1][C][Ring2][Ring1][Ring2]
|
c19cccc%12c1.C128CC%11(C1)C2.O=C5CC%10.c1%12cscn1.C1%10CC1.C69=O.N58.C7%11.N67
|
CC[C@H](C)[C@H](C)C(=O)NC[C@H]1C[C@](F)(CNC(=O)c2cc(O)nc(C3CC3)c2)C1
|
CC[C@H]C)[C@H]C)C=O)NC[C@H]C[C@]F)CNC=O)cccO)ncCCC3)))c6)))))))))C4
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@][Branch1][C][F][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring1]
|
CC[C@H](C)[C@H](C)C4=O.c18cc%11nc(O)c1.[C@H]19C[C@@]%10(F)C1.C58=O.C1%11CC1.N46.C69.C7%10.N57
|
CC1=NO[C@@H](CNC(=O)C#CCNC(=O)c2nccc(C)c2F)C1
|
CC=NO[C@@H]CNC=O)C#CCNC=O)cncccC)c6F)))))))))))))))C5
|
[C][C][=N][O][C@@H1][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][C][#C][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][F][C][Ring2][Ring1][#Branch1]
|
c17nccc(C)c1F.CC1=NO[C@@H]8C1.C3(=O)C#CC6.C47=O.C58.N35.N46
|
C[C@@H](NC(=O)C(C)(C)c1ccc(N)cc1)[C@H]1CCCOC1
|
C[C@@H]NC=O)CC)C)ccccN)cc6)))))))))[C@H]CCCOC6
|
[C][C@@H1][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C@H1][C][C][C][O][C][Ring1][=Branch1]
|
c15ccc(N)cc1.C2(=O)C5(C)C.[C@H]14CCCOC1.C[C@@H]34.N23
|
N#CC12C3C4C1C1C2C3C41C(=O)NCC1CN(C(=O)c2cc3scc(Cl)c3[nH]2)C1
|
N#CCCCC4CC6C6C64C=O)NCCCNC=O)cccsccCl)c5[nH]8)))))))))C4
|
[N][#C][C][C][C][C][Ring1][Ring2][C][C][Ring1][=Branch1][C][Ring1][=Branch1][C][Ring1][=Branch1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][S][C][=C][Branch1][C][Cl][C][=Ring1][=Branch1][NH1][Ring1][=Branch2][C][Ring1][#C]
|
N#CC12C3C4C1C1C2C3C419.c18cc2scc(Cl)c2[nH]1.C1%10CN6C1.C59=O.C68=O.N57.C7%10
|
O=C(COCC(F)(F)F)N1CCC[C@@H]2[C@H]1CCN2Cc1sccc1Cl
|
O=CCOCCF)F)F)))))NCCC[C@@H][C@H]6CCN5Ccsccc5Cl
|
[O][=C][Branch1][N][C][O][C][C][Branch1][C][F][Branch1][C][F][F][N][C][C][C][C@@H1][C@H1][Ring1][=Branch1][C][C][N][Ring1][Branch1][C][C][S][C][=C][C][=Ring1][Branch1][Cl]
|
N13CCC[C@@H]2[C@H]1CCN26.c17sccc1Cl.C5C(F)(F)F.O=C3C4.O45.C67
|
C=CC[C@@H](CNC(=O)C(=O)C[C@@H](C)CC)C(=O)N(CCC)CC1CC1
|
C=CC[C@@H]CNC=O)C=O)C[C@@H]C)CC))))))))C=O)NCCC)))CCCC3
|
[C][=C][C][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][C][C][C][C][C][Ring1][Ring1]
|
C2(=O)C(=O)C[C@@H](C)CC.C=CC[C@@H](C4)C3=O.N356.C5CC.C17CC1.N24.C67
|
Cc1nc([C@@H](C)NC(=O)[C@]2(F)C[C@H]3CNC[C@@H]2C3)no1
|
Ccnc[C@@H]C)NC=O)[C@]F)C[C@H]CNC[C@@H]7C6)))))))))))no5
|
[C][C][=N][C][Branch2][Ring1][=Branch2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][F][C][C@H1][C][N][C][C@@H1][Ring1][Branch2][C][Ring1][=Branch1][=N][O][Ring2][Ring1][Ring1]
|
[C@@]16(F)C[C@H]2CNC[C@@H]1C2.Cc1nc7no1.[C@H]57C.C46=O.N45
|
CCCc1nc(C(=O)N2CC[C@H](CNC(=O)C[C@H]3CCC34CCC4)C23CC3)co1
|
CCCcncC=O)NCC[C@H]CNC=O)C[C@H]CCC4CCC4)))))))))))C5CC3))))))))co5
|
[C][C][C][C][=N][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][Ring1][Ring2][C][C][C][Ring1][Ring2][C][Ring1][P][C][C][Ring1][Ring1][=C][O][Ring2][Ring1][#Branch2]
|
N15CC[C@H]%10C12CC2.[C@H]1%11CCC12CCC2.c19nc8co1.C6(=O)C%11.CCC9.C58=O.C7%10.N67
|
O[C@@H](Cn1cc(CO[C@H]2CCCCO2)nn1)c1cccc(Br)c1
|
O[C@@H]CnccCO[C@H]CCCCO6))))))))nn5))))))cccccBr)c6
|
[O][C@@H1][Branch2][Ring1][Branch1][C][N][C][=C][Branch1][O][C][O][C@H1][C][C][C][C][O][Ring1][=Branch1][N][=N][Ring1][=N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1]
|
c17cccc(Br)c1.n15cc6nn1.[C@H]14CCCCO1.O[C@H]7C5.C36.O34
|
CO[C@@H]1CN(C(=O)Cc2c(C)cccc2Cl)C[C@@H]1NC(=O)c1cccn(C)c1=O
|
CO[C@@H]CNC=O)CccC)cccc6Cl)))))))))C[C@@H]5NC=O)ccccnC)c6=O
|
[C][O][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][Cl][C][C@@H1][Ring1][S][N][C][=Branch1][C][=O][C][=C][C][=C][N][Branch1][C][C][C][Ring1][#Branch1][=O]
|
c18c(C)cccc1Cl.c17cccn(C)c1=O.[C@@H]15CN3C[C@@H]16.C3(=O)C8.C47=O.CO5.N46
|
CC(C)c1n[nH]cc1CNC(=O)C[C@@H]1CCN1C(=O)[C@H]1CCCCS1
|
CCC)cn[nH]cc5CNC=O)C[C@@H]CCN4C=O)[C@H]CCCCS6
|
[C][C][Branch1][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C@H1][C][C][C][C][S][Ring1][=Branch1]
|
c17n[nH]cc18.[C@H]15CCCCS1.[C@@H]16CCN13.C2(=O)C6.CC7C.C35=O.C48.N24
|
CCCN(C)[C@H](C)CCNC(=O)/C=C/[C@H]1CCCN1C(=O)c1cc(Cl)cs1
|
CCCNC)[C@H]C)CCNC=O)/C=C/[C@H]CCCN5C=O)cccCl)cs5
|
[C][C][C][N][Branch1][C][C][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][/C][=C][/C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][S][Ring1][=Branch1]
|
C=8[C@H]1CCCN13.c17cc(Cl)cs1.[C@@H]5(C)CC6.C2(=O)C=8.CCC4.N45C.C37=O.N26
|
CC[C@@H](SC)C(=O)N[C@]1(C)C[C@@H](NC(=O)C2=Cc3ccccc3[C@@H]2O)C1
|
CC[C@@H]SC))C=O)N[C@]C)C[C@@H]NC=O)C=Ccccccc6[C@@H]9O))))))))))))C4
|
[C][C][C@@H1][Branch1][Ring1][S][C][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Ring1][=Branch2][O][C][Ring2][Ring1][C]
|
C5(=O)C1=Cc2ccccc2[C@@H]1O.CC[C@@H]7C4=O.[C@]16(C)C[C@H]8C1.S7C.N46.N58
|
C=CC1(CC(=O)NC[C@H]2C=C[C@@H](NC(=O)Cc3cccnc3C)C2)CCC1
|
C=CCCC=O)NC[C@H]C=C[C@@H]NC=O)Cccccnc6C))))))))))C5)))))))))CCC4
|
[C][=C][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@H1][C][=C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][S][C][C][C][Ring2][Ring1][=Branch2]
|
c1%10cccnc1C.C=CC18CCC1.[C@H]19C=C[C@@H]7C1.C8C4=O.C5(=O)C%10.N46.C69.N57
|
Cc1nc(CN(C)C(=O)[C@@H](NC(=O)c2ccc(C#N)c(C)c2)[C@@H](C)O)n[nH]1
|
CcncCNC)C=O)[C@@H]NC=O)ccccC#N))cC)c6))))))))[C@@H]C)O))))))n[nH]5
|
[C][C][=N][C][Branch2][Ring2][#Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][C][C][=C][Ring1][=Branch2][C@@H1][Branch1][C][C][O][=N][NH1][Ring2][Ring1][#Branch2]
|
c17ccc(C#N)c(C)c1.C3(=O)[C@@H]6[C@@H](C)O.Cc1nc8n[nH]1.N35C.C47=O.C58.N46
|
COCc1cc(CC(=O)N[C@@H]2C[C@H](OC)CN(C(=O)c3ccsc3Cl)C2)no1
|
COCcccCC=O)N[C@@H]C[C@H]OC))CNC=O)cccsc5Cl)))))))C6)))))))))no5
|
[C][O][C][C][=C][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][Ring1][O][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][Cl][C][Ring1][S][=N][O][Ring2][Ring1][=Branch2]
|
[C@@H]18C[C@H]7CN5C1.c1%10cc%11no1.c19ccsc1Cl.C%11C4=O.C59=O.CO6.C6%10.N48.O7C
|
O=C(NCCC(F)(F)Cl)[C@H]1[C@@H]2CN(C(=O)c3ncc[nH]3)C[C@@H]21
|
O=CNCCCF)F)Cl)))))[C@H][C@@H]CNC=O)cncc[nH]5))))))C[C@@H]56
|
[O][=C][Branch1][N][N][C][C][C][Branch1][C][F][Branch1][C][F][Cl][C@H1][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][NH1][Ring1][Branch1][C][C@@H1][Ring1][N][Ring1][=N]
|
[C@@H]18[C@H]2CN5C[C@@H]12.C6CC(F)(F)Cl.c17ncc[nH]1.O=C48.C57=O.N46
|
CCOc1nc(C(=O)N[C@@H]2CCN(C(=O)c3n[nH]c4c3COCC4)C23CC3)co1
|
CCOcncC=O)N[C@@H]CCNC=O)cn[nH]cc5COCC6))))))))))C5CC3)))))))))co5
|
[C][C][O][C][=N][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][O][C][C][Ring1][=Branch1][C][Ring1][S][C][C][Ring1][Ring1][=C][O][Ring2][Ring1][#Branch2]
|
c1%11n[nH]c2c1COCC2.[C@@H]19CCN6C12CC2.c18nc%10co1.C5%10=O.C6%11=O.CC7.O78.N59
|
CN(C[C@H](O)CNC(=O)[C@H]1C(F)(F)C12CC2)C(=O)c1cc(F)ccc1Br
|
CNC[C@H]O)CNC=O)[C@H]CF)F)C3CC3))))))))))C=O)cccF)ccc6Br
|
[C][N][Branch2][Ring1][O][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C@H1][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch1][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Br]
|
c18cc(F)ccc1Br.[C@H]17C(F)(F)C12CC2.C5[C@H](O)C6.CN45.C37=O.C48=O.N36
|
CC=C(CC)C(=O)N1C[C@@H]2CN(C(=O)c3cccc(CSC)c3)C[C@]2(C)C1
|
CC=CCC))C=O)NC[C@@H]CNC=O)cccccCSC)))c6)))))))C[C@]5C)C8
|
[C][C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring2][C][S][C][=C][Ring1][=Branch2][C][C@][Ring1][S][Branch1][C][C][C][Ring2][Ring1][Ring2]
|
N14C[C@@H]2CN5C[C@]2(C)C1.c17cccc9c1.C=8(CC)C4=O.C57=O.CC=8.C69.S6C
|
CCc1conc1C(=O)N[C@@H](Cn1cccn1)C(=O)N[C@@H](C)c1cnn[nH]1
|
CCcconc5C=O)N[C@@H]Cncccn5))))))C=O)N[C@@H]C)ccnn[nH]5
|
[C][C][C][=C][O][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=C][N][=N][NH1][Ring1][Branch1]
|
c19conc16.[C@H]4(C7)C3=O.n17cccn1.c18cnn[nH]1.C26=O.[C@@H]58C.CC9.N24.N35
|
CC1(C)[C@@H](O)[C@H]2CCN(C(=O)[C@H]3CCN(C(=O)c4ccc(F)s4)C[C@H]3O)[C@H]21
|
CCC)[C@@H]O)[C@H]CCNC=O)[C@H]CCNC=O)ccccF)s5))))))C[C@H]6O))))))))[C@H]57
|
[C][C][Branch1][C][C][C@@H1][Branch1][C][O][C@H1][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][S][Ring1][=Branch1][C][C@H1][Ring1][=C][O][C@H1][Ring2][Ring1][=Branch1][Ring2][Ring1][#Branch2]
|
CC1(C)[C@@H](O)[C@H]2CCN5[C@H]21.[C@H]18CCN6C[C@H]1O.c17ccc(F)s1.C58=O.C67=O
|
Cc1sc(NC(=O)N2CC[C@H](SC(F)F)C2)nc1-c1cccc(Cl)c1
|
CcscNC=O)NCC[C@H]SCF)F)))C5)))))))nc5-cccccCl)c6
|
[C][C][S][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][#Branch1][S][C][Branch1][C][F][F][C][Ring1][=Branch2][=N][C][=Ring1][P][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]
|
Cc1sc5nc17.c17cccc(Cl)c1.N14CC[C@H]6C1.S6C(F)F.C34=O.N35
|
CC1CC(C(=O)N(CCCNC(=O)C2CC(C)(C)C2)CC2CCCC2)C1
|
CCCCC=O)NCCCNC=O)CCCC)C)C4)))))))))CCCCCC5))))))))C4
|
[C][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][C][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
C19CC(C)(C)C1.CC1CC8C1.C1%10CCCC1.C5CC6.C38=O.N357.C49=O.N46.C7%10
|
CN1CCC(F)(C(=O)N2CC[C@](O)(CNC(=O)[C@H]3CC34CCCCCC4)C2)CC1
|
CNCCCF)C=O)NCC[C@]O)CNC=O)[C@H]CC3CCCCCC7))))))))))))C5))))))CC6
|
[C][N][C][C][C][Branch1][C][F][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][O][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][C][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][N]
|
[C@H]19CC12CCCCCC2.CN1CCC8(F)CC1.N15CC[C@@]%10(O)C1.C58=O.C69=O.C7%10.N67
|
Cc1nc(-c2cc[nH]n2)sc1CC(=O)NC[C@H](F)CNC(=O)Cc1cnccn1
|
Ccnc-ccc[nH]n5)))))sc5CC=O)NC[C@H]F)CNC=O)Cccnccn6
|
[C][C][N][=C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][S][C][=Ring1][#Branch2][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][F][C][N][C][=Branch1][C][=O][C][C][=C][N][=C][C][=N][Ring1][=Branch1]
|
Cc1nc9sc17.c18cnccn1.c19cc[nH]n1.C5[C@H](F)C6.C7C3=O.C4(=O)C8.N35.N46
|
CC(C)[C@@H](CNC(=O)CCc1ccncc1)NC(=O)[C@]1(C(F)(F)F)CC[C@@H](F)C1
|
CCC)[C@@H]CNC=O)CCcccncc6)))))))))))NC=O)[C@]CF)F)F))CC[C@@H]F)C5
|
[C][C][Branch1][C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][C@@H1][Branch1][C][F][C][Ring1][#Branch2]
|
[C@@]167CC[C@@H](F)C1.CC(C)[C@H]4C5.c18ccncc1.C2(=O)CC8.C7(F)(F)F.C36=O.N25.N34
|
NCC(=O)N1CC(NC(=O)Cc2cccc(Br)c2I)C1
|
NCC=O)NCCNC=O)CcccccBr)c6I))))))))))C4
|
[N][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][I][C][Ring1][S]
|
c16cccc(Br)c1I.N13CC5C1.NCC3=O.C4(=O)C6.N45
|
O=C(CC[C@@H]1CCOC1)NCCNC(=O)c1sc(C2CC2)nc1C(F)(F)F
|
O=CCC[C@@H]CCOC5)))))))NCCNC=O)cscCCC3)))nc5CF)F)F
|
[O][=C][Branch1][#Branch2][C][C][C@@H1][C][C][O][C][Ring1][Branch1][N][C][C][N][C][=Branch1][C][=O][C][S][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=Ring1][Branch2][C][Branch1][C][F][Branch1][C][F][F]
|
c17sc%10nc18.O=C3CC9.[C@@H]19CCOC1.C8(F)(F)F.C5C6.C47=O.C1%10CC1.N35.N46
|
CSc1ncc(CN2C[C@@H]3[C@H](C2)[C@@H]3C(=O)N2CCSCC2)cn1
|
CScnccCNC[C@@H][C@H]C5)[C@@H]3C=O)NCCSCC6)))))))))))))cn6
|
[C][S][C][=N][C][=C][Branch2][Ring1][#Branch2][C][N][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][S][C][C][Ring1][=Branch1][C][=N][Ring2][Ring1][Branch1]
|
c18ncc7cn1.N15C[C@@H]2[C@H]6[C@@H]2C1.N14CCSCC1.C46=O.CS8.C57
|
COC[C@]1(NC(=O)C2=COCCC2)CCN(C(=O)[C@H]2C[C@H](OC)CN2C(C)=O)C1
|
COC[C@]NC=O)C=COCCC6))))))))CCNC=O)[C@H]C[C@H]OC))CN5CC)=O))))))))C5
|
[C][O][C][C@][Branch1][=C][N][C][=Branch1][C][=O][C][=C][O][C][C][C][Ring1][=Branch1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C@H1][Branch1][Ring1][O][C][C][N][Ring1][#Branch1][C][Branch1][C][C][=O][C][Ring2][Ring1][#Branch2]
|
C3(=O)C1=COCCC1.[C@]18%10CCN4C1.[C@H]19C[C@H]7CN15.C49=O.C5(C)=O.CO6.C6%10.N38.O7C
|
COc1ncc(C(=O)N2CCC(NC(=O)c3ncn(C)n3)CC2)cc1Cl
|
COcnccC=O)NCCCNC=O)cncnC)n5)))))))CC6)))))))cc6Cl
|
[C][O][C][=N][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][N][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][C][Ring1][#C][C][=C][Ring2][Ring1][#Branch1][Cl]
|
c16ncc9cc1Cl.N14CCC7CC1.c18ncn(C)n1.C49=O.C58=O.CO6.N57
|
O=C(C1=CCCS1)N1CC[C@H]([C@@H]2CCCCN2C(=O)C2CCC(O)CC2)C1
|
O=CC=CCCS5)))))NCC[C@H][C@@H]CCCCN6C=O)CCCCO)CC6)))))))))))))C5
|
[O][=C][Branch1][Branch2][C][=C][C][C][S][Ring1][Branch1][N][C][C][C@H1][Branch2][Ring1][Branch2][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][C][Ring2][Ring1][Ring2]
|
O=C3C1=CCCS1.[C@@H]16CCCCN14.C15CCC(O)CC1.N13CC[C@H]6C1.C45=O
|
Cc1ncc(C(=O)N[C@H]2CCC[C@@H]2CNC(=O)c2ccc(O)cc2F)[nH]1
|
CcnccC=O)N[C@H]CCC[C@@H]5CNC=O)ccccO)cc6F)))))))))))))))))[nH]5
|
[C][C][=N][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][F][NH1][Ring2][Ring1][=Branch2]
|
c18ccc(O)cc1F.Cc1ncc7[nH]1.[C@H]16CCC[C@@H]19.C37=O.C48=O.N36.C59.N45
|
C[C@H]1CCC[C@@]1(NC(=O)Cn1cnnn1)C(=O)N(C)Cc1cnco1
|
C[C@H]CCC[C@@]5NC=O)Cncnnn5))))))))C=O)NC)Cccnco5
|
[C][C@H1][C][C][C][C@@][Ring1][Branch1][Branch1][=C][N][C][=Branch1][C][=O][C][N][C][=N][N][=N][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][N][=C][O][Ring1][Branch1]
|
C[C@H]1CCC[C@@]146.n17cnnn1.c18cnco1.C2(=O)C7.C36=O.N35C.N24.C58
|
CC(=O)NC[C@H](CC(=O)N[C@]1(CO)CCN(C(=O)c2cccs2)C1)CC(C)C
|
CC=O)NC[C@H]CC=O)N[C@]CO))CCNC=O)ccccs5))))))C5))))))))CCC)C
|
[C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C@][Branch1][Ring1][C][O][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][Ring1][=C][C][C][Branch1][C][C][C]
|
C6[C@H](CC4=O)CC(C)C.[C@@]179CCN5C1.c18cccs1.CC3=O.C58=O.N36.N47.C9O
|
CCn1nnnc1[C@](C)(C[C@@H]1CCCCO1)NCCc1cn(C)c2ccccc12
|
CCnnnnc5[C@]C)C[C@@H]CCCCO6)))))))NCCccnC)cccccc96
|
[C][C][N][N][=N][N][=C][Ring1][Branch1][C@][Branch1][C][C][Branch1][#Branch2][C][C@@H1][C][C][C][C][O][Ring1][=Branch1][N][C][C][C][=C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1]
|
c18cn(C)c2ccccc12.n15nnnc17.[C@@H]16CCCCO1.[C@@]37(C)C6.C4C8.CC5.N34
|
CCCC=CC(=O)N[C@H]1COC[C@H]1C(=O)N1CC(SC)C1
|
CCCC=CC=O)N[C@H]COC[C@H]5C=O)NCCSC))C4
|
[C][C][C][C][=C][C][=Branch1][C][=O][N][C@H1][C][O][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][S][C][C][Ring1][=Branch1]
|
[C@H]14COC[C@H]15.N13CC7C1.CCCC=6.C=6C2=O.C35=O.N24.S7C
|
CO[C@@H](C(=O)NC1(C2CN(C(=O)Cc3cc(F)c(C)cc3F)C2)CC1)C1CCC1
|
CO[C@@H]C=O)NCCCNC=O)CcccF)cC)cc6F)))))))))C4))))CC3)))))CCCC4
|
[C][O][C@@H1][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][C][F][=C][Branch1][C][C][C][=C][Ring1][Branch2][F][C][Ring1][S][C][C][Ring2][Ring1][Ring1][C][C][C][C][Ring1][Ring2]
|
c19cc(F)c(C)cc1F.C17(C2CN5C2)CC1.[C@@H]68C4=O.C5(=O)C9.C18CCC1.CO6.N47
|
CN(Cc1conc1C1CC1)C(=O)[C@]12COC[C@H]1C2(F)F
|
CNCcconc5CCC3)))))))))C=O)[C@]COC[C@H]5C6F)F
|
[C][N][Branch1][=C][C][C][=C][O][N][=C][Ring1][Branch1][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C@][C][O][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][Branch1][C][F][F]
|
[C@]125COC[C@H]1C2(F)F.c16conc17.CN34.C17CC1.C35=O.C46
|
Cc1ccncc1CN(C)C(=O)COC1CN(C(=O)[C@@]2(C)C=CCCC2)C1
|
Ccccncc6CNC)C=O)COCCNC=O)[C@@]C)C=CCCC6)))))))C4
|
[C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@][Branch1][C][C][C][=C][C][C][C][Ring1][#Branch1][C][Ring1][=N]
|
Cc1ccncc19.[C@]18(C)C=CCCC1.C16CN4C1.C3(=O)C5.N37C.C48=O.C79.O56
|
O=C(Cc1cccs1)N1CC(F)(C(=O)N2CCC[C@H](CC3CC3)C2)C1
|
O=CCccccs5))))))NCCF)C=O)NCCC[C@H]CCCC3))))C6)))))))C4
|
[O][=C][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][N][C][C][Branch1][C][F][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][#Branch2][C][Ring1][P]
|
N15CCC[C@H]8C1.N14CC6(F)C1.c17cccs1.O=C4C7.C56=O.C19CC1.C89
|
C#CCn1c(C)cc(C(=O)N2CCN(C(=O)[C@@H](C)CC(F)(F)F)C3(CC3)C2)c1C
|
C#CCncC)ccC=O)NCCNC=O)[C@@H]C)CCF)F)F)))))CCC3))C6)))))))c5C
|
[C][#C][C][N][C][Branch1][C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][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][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][P][=C][Ring2][Ring1][=Branch2][C]
|
N14CCN5C2(CC2)C1.C5(=O)[C@@H](C)CC(F)(F)F.n17c(C)cc6c1C.C#CC7.C46=O
|
CCCc1[nH]ccc1C(=O)N1C[C@H]2CC[C@@]2(CCNC(=O)C2CC(F)(F)C2)C1
|
CCCc[nH]ccc5C=O)NC[C@H]CC[C@@]4CCNC=O)CCCF)F)C4))))))))C7
|
[C][C][C][C][NH1][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@][Ring1][Ring2][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
N13C[C@H]2CC[C@@]29C1.c18[nH]ccc17.C16CC(F)(F)C1.CCC8.C37=O.C9C5.C46=O.N45
|
CC[C@H](CN(C)C(=O)[C@@H]1CC[C@@H](O)CN1C(=O)[C@@H](C)N1CCCC1)OC
|
CC[C@H]CNC)C=O)[C@@H]CC[C@@H]O)CN6C=O)[C@@H]C)NCCCC5))))))))))))))))OC
|
[C][C][C@H1][Branch2][Ring2][Ring2][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Branch1][C][O][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][C][C][C][Ring1][Branch1][O][C]
|
[C@@H]17CC[C@@H](O)CN13.CC[C@@H]4C5.C3(=O)[C@H]6C.N16CCCC1.N25C.C27=O.O4C
|
NC(=O)CS(=O)(=O)c1ccc(C(=O)Nc2ccc(C3CCC3)cn2)cc1
|
NC=O)CS=O)=O)ccccC=O)NccccCCCC4))))cn6))))))))cc6
|
[N][C][=Branch1][C][=O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][=N][Ring1][#Branch2][C][=C][Ring2][Ring1][Ring1]
|
NC(=O)CS(=O)(=O)c1ccc6cc1.c15ccc7cn1.C17CCC1.C46=O.N45
|
N#CC[C@@H]1CN(C(=O)Cc2ccc(Cl)cn2)CCN1C(=O)[C@H](O)c1ccccc1
|
N#CC[C@@H]CNC=O)CccccCl)cn6))))))))CCN6C=O)[C@H]O)cccccc6
|
[N][#C][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1][C][C][N][Ring1][S][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
[C@@H]15CN3CCN14.c16ccc(Cl)cn1.c17ccccc1.C4(=O)[C@@H]7O.C3(=O)C6.N#CC5
|
C[C@H](NC(=O)c1c2c(c[nH]c1=N)CCC2)[C@@H](C)NC(=O)C(C)(C)C(F)(F)F
|
C[C@H]NC=O)cccc[nH]c6=N))))CCC5))))))))[C@@H]C)NC=O)CC)C)CF)F)F
|
[C][C@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=Branch1][#Branch1][=C][NH1][C][Ring1][=Branch1][=N][C][C][C][Ring1][=Branch2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
c17c2c(c[nH]c1=N)CCC2.C4(=O)C(C)(C)C(F)(F)F.C[C@H]5[C@H]6C.C37=O.N35.N46
|
C[C@H](CC(=O)N[C@@H]1C=CCN(C(=O)[C@H]2C[C@H]2C(=O)NCCO)C1)c1cnn(C)c1
|
C[C@H]CC=O)N[C@@H]C=CCNC=O)[C@H]C[C@H]3C=O)NCCO)))))))))C6)))))))))ccnnC)c5
|
[C][C@H1][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C@@H1][C][=C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][O][C][Ring1][P][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
[C@@H]17C=CCN4C1.C[C@@H]%10CC3=O.c1%10cnn(C)c1.[C@H]18C[C@H]19.C48=O.C59=O.C6CO.N37.N56
|
C[C@@]1(C(=O)NCCCC2CCOCC2)CCN(C(=O)Cc2cc[nH]c2)C1
|
C[C@@]C=O)NCCCCCCOCC6)))))))))))CCNC=O)Cccc[nH]c5)))))))C5
|
[C][C@@][Branch1][P][C][=Branch1][C][=O][N][C][C][C][C][C][C][O][C][C][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][NH1][C][=Ring1][Branch1][C][Ring2][Ring1][=Branch2]
|
C[C@@]16CCN4C1.C17CCOCC1.c18cc[nH]c1.C5CC7.C4(=O)C8.C36=O.N35
|
CC1CCC(=CC(=O)NC2(C3(O)CCN(C(=O)[C@H]4C=CCC4)CC3)CC2)CC1
|
CCCCC=CC=O)NCCO)CCNC=O)[C@H]C=CCC5))))))CC6))))))CC3))))))CC6
|
[C][C][C][C][C][=Branch2][Ring2][#Branch1][=C][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch2][C][Branch1][C][O][C][C][N][Branch1][N][C][=Branch1][C][=O][C@H1][C][=C][C][C][Ring1][Branch1][C][C][Ring1][=C][C][C][Ring1][P][C][C][Ring2][Ring1][O]
|
C17(C2(O)CCN6CC2)CC1.CC1CCC=9CC1.[C@H]18C=CCC1.C=9C5=O.C68=O.N57
|
O=C(Cc1ccsc1)N[C@H]1CCN(C(=O)C[C@@H]2CCC23CCC3)C[C@@H]1O
|
O=CCcccsc5))))))N[C@H]CCNC=O)C[C@@H]CCC4CCC4)))))))))C[C@@H]6O
|
[O][=C][Branch1][=Branch2][C][C][C][=C][S][C][=Ring1][Branch1][N][C@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C@@H1][C][C][C][Ring1][Ring2][C][C][C][Ring1][Ring2][C][C@@H1][Ring1][S][O]
|
[C@H]16CCN5C[C@@H]1O.[C@@H]17CCC12CCC2.c18ccsc1.O=C4C8.C5(=O)C7.N46
|
CC[C@]1(C)C[C@H](NC(=O)CSCCNC(=O)c2sccc2C)CCO1
|
CC[C@]C)C[C@H]NC=O)CSCCNC=O)csccc5C))))))))))))))CCO6
|
[C][C][C@][Branch1][C][C][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][S][C][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][C][C][C][O][Ring2][Ring1][#Branch1]
|
[C@@]1%10(C)C[C@H]8CCO1.c19sccc1C.C3(=O)C6.C7C5.C49=O.CC%10.N38.S67.N45
|
COCC(C)(C)C(=O)N1[C@H](CNC(=O)Cc2cnccc2Cl)C[C@@H]2COC[C@@H]21
|
COCCC)C)C=O)N[C@H]CNC=O)Cccnccc6Cl)))))))))))C[C@@H]COC[C@@H]58
|
[C][O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][=C][N][=C][C][=C][Ring1][=Branch1][Cl][C][C@@H1][C][O][C][C@@H1][Ring1][Branch1][Ring2][Ring1][Ring2]
|
N13[C@H]7C[C@@H]2COC[C@@H]21.C5C(C)(C)C3=O.c18cnccc1Cl.C4(=O)C8.CO5.C67.N46
|
Cn1cc(C(=O)NCCCNC(=O)[C@@H]2CCCc3nncn32)n2cncc2c1=O
|
CnccC=O)NCCCNC=O)[C@@H]CCCcnncn59))))))))))))))))ncncc5c9=O
|
[C][N][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][=N][N][=C][N][Ring1][Branch1][Ring1][=Branch2][N][C][=N][C][=C][Ring1][Branch1][C][Ring2][Ring1][O][=O]
|
Cn1cc8n2cncc2c1=O.C5(=O)[C@@H]1CCCc2nncn21.C6CC7.C48=O.N46.N57
|
CC(C)[C@@H](O)CC(=O)N1C[C@H](O)C[C@H]1CNC(=O)c1cccc(C(C)(C)C)c1
|
CCC)[C@@H]O)CC=O)NC[C@H]O)C[C@H]5CNC=O)cccccCC)C)C))c6
|
[C][C][Branch1][C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][#Branch2]
|
CC(C)[C@@H](O)CC2=O.N12C[C@H](O)C[C@H]16.c15cccc7c1.C7(C)(C)C.C35=O.C46.N34
|
CC1(NC(=O)[C@@H]2C[C@@H]2F)CN(C(=O)c2cc3c(nc2O)C(C)(C)CCC3)C1
|
CCNC=O)[C@@H]C[C@@H]3F))))))CNC=O)ccccnc6O)))CC)C)CCC6)))))))))C4
|
[C][C][Branch1][N][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][F][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N][=C][Ring1][=Branch1][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][O][C][Ring2][Ring1][#Branch2]
|
c18cc2c(nc1O)C(C)(C)CCC2.CC16CN5C1.[C@@H]17C[C@@H]1F.C47=O.C58=O.N46
|
Cc1c(NC(=O)CC2C=NN(C)C2=O)cccc1OC(F)F
|
CccNC=O)CCC=NNC)C5=O)))))))))cccc6OCF)F
|
[C][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=N][N][Branch1][C][C][C][Ring1][=Branch1][=O][C][=C][C][=C][Ring1][P][O][C][Branch1][C][F][F]
|
Cc1c4cccc15.C16C=NN(C)C1=O.C3(=O)C6.O4C(F)F.N35
|
CCOC(=O)C1(CNC(=O)[C@@H]([C@@H](C)CC2CC2)N2C[C@@H](O)[C@@H](O)C2)CC1
|
CCOC=O)CCNC=O)[C@@H][C@@H]C)CCCC3)))))NC[C@@H]O)[C@@H]O)C5)))))))))CC3
|
[C][C][O][C][=Branch1][C][=O][C][Branch2][Ring1][P][C][N][C][=Branch1][C][=O][C@@H1][Branch1][O][C@@H1][Branch1][C][C][C][C][C][C][Ring1][Ring1][N][C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C][Ring1][#Branch1][C][C][Ring2][Ring1][Branch1]
|
C4(=O)[C@H]7[C@@H](C)C%10.N17C[C@@H](O)[C@@H](O)C1.C189CC1.C38=O.C1%10CC1.CC5.O35.C69.N46
|
Cc1[nH]nc(C(=O)N[C@@]23CCN(C(=O)c4nccc5ccsc45)C[C@H]2C3)c1O
|
Cc[nH]ncC=O)N[C@@]CCNC=O)cncccccsc95))))))))))C[C@H]6C7)))))))))c5O
|
[C][C][NH1][N][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@@][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][C][=C][C][C][=C][S][C][Ring1][=Branch2][=Ring1][Branch1][C][C@H1][Ring1][P][C][Ring2][Ring1][C][C][=Ring2][Ring1][#Branch2][O]
|
c1%10nccc2ccsc12.[C@@]128CCN7C[C@H]1C2.Cc1[nH]nc9c1O.C69=O.C7%10=O.N68
|
C[C@H](OCC1CC1)C(=O)N1CCCN(C(=O)c2cnn(C)c2N)[C@H](C)C1
|
C[C@H]OCCCC3)))))C=O)NCCCNC=O)ccnnC)c5N)))))))[C@H]C)C7
|
[C][C@H1][Branch1][Branch2][O][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][N][C@H1][Branch1][C][C][C][Ring1][P]
|
N13CCCN4[C@H](C)C1.c17cnn(C)c1N.C[C@H]5C3=O.C18CC1.C47=O.O56.C68
|
CC1CC(CC(=O)NC2(CCCNC(=O)Cc3cccs3)CC2)C1
|
CCCCCC=O)NCCCCNC=O)Cccccs5)))))))))))CC3))))))C4
|
[C][C][C][C][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][Branch1][P][C][C][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][#C][C][Ring2][Ring1][#Branch1]
|
CC1CC9C1.c18cccs1.C9C4=O.C16%10CC1.C%10CC7.C5(=O)C8.N46.N57
|
O[C@H](CN1CCC12CC1(CCOCC1)C2)c1ccccc1
|
O[C@H]CNCCC4CCCCOCC6)))))C4))))))))cccccc6
|
[O][C@H1][Branch2][Ring1][=Branch1][C][N][C][C][C][Ring1][Ring2][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
N13CCC12CC1(CCOCC1)C2.c14ccccc1.O[C@@H]4C3
|
Cc1cc(C(=O)N[C@@H]2CC[C@H](NC(=O)c3cccc(-c4nc[nH]n4)c3)C2)cn1C
|
CcccC=O)N[C@@H]CC[C@H]NC=O)ccccc-cnc[nH]n5)))))c6))))))))C5)))))))cn5C
|
[C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][C][N][=C][NH1][N][=Ring1][Branch1][=C][Ring1][O][C][Ring2][Ring1][Ring1][=C][N][Ring2][Ring1][O][C]
|
Cc1cc9cn1C.c1%10cccc%11c1.[C@@H]17CC[C@H]8C1.c1%11nc[nH]n1.C59=O.C6%10=O.N57.N68
|
Cc1ccc(O)c(C(=O)N2CCCC23CCN(C(=O)CCc2cn[nH]c2)CC3)n1
|
CccccO)cC=O)NCCCC5CCNC=O)CCccn[nH]c5))))))))CC6)))))))))))n6
|
[C][C][=C][C][=C][Branch1][C][O][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][=N][NH1][C][=Ring1][Branch1][C][C][Ring1][#C][=N][Ring2][Ring1][N]
|
N14CCCC12CCN5CC2.Cc1ccc(O)c6n1.C5(=O)CC7.c17cn[nH]c1.C46=O
|
CC(C)C[C@H](CCO)NC(=O)[C@H]1CC=C[C@H](NC(=O)C(C)(C)C2CC2)C1
|
CCC)C[C@H]CCO)))NC=O)[C@H]CC=C[C@H]NC=O)CC)C)CCC3))))))C6
|
[C][C][Branch1][C][C][C][C@H1][Branch1][Ring2][C][C][O][N][C][=Branch1][C][=O][C@H1][C][C][=C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring1][#C]
|
CC(C)C[C@@H]5CCO.[C@H]17CC=C[C@H]6C1.C4(=O)C8(C)C.C37=O.C18CC1.N35.N46
|
C[C@@H]1CCC[C@H](CC(=O)NCCC[C@@H](C)NC(=O)c2nc[nH]c3nccc2-3)C1
|
C[C@@H]CCC[C@H]CC=O)NCCC[C@@H]C)NC=O)cnc[nH]cnccc9-5))))))))))))))))))C6
|
[C][C@@H1][C][C][C][C@H1][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][=C][NH1][C][=N][C][=C][C][=Ring1][=Branch2][Ring1][Branch1][C][Ring2][Ring1][O]
|
c18nc[nH]c2nccc1-2.C[C@@H]1CCC[C@H]9C1.C6CC[C@H]7C.C9C4=O.C58=O.N46.N57
|
CC#CCCC(=O)N1C[C@@H](C)[C@H](NC(=O)c2snnc2CCC)C1
|
CC#CCCC=O)NC[C@@H]C)[C@H]NC=O)csnnc5CCC))))))))))C5
|
[C][C][#C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][S][N][=N][C][=Ring1][Branch1][C][C][C][C][Ring1][P]
|
CC#CCCC3=O.N13C[C@@H]5[C@H](C)C1.c16snnc17.C46=O.C7CC.N45
|
C[C@H](NC(=O)c1cnc(N(C)C)s1)[C@@H]1CN(C(=O)CCCC(C)(C)C#N)CCO1
|
C[C@H]NC=O)ccncNC)C))s5)))))))[C@@H]CNC=O)CCCCC)C)C#N)))))))CCO6
|
[C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][N][Branch1][C][C][C][S][Ring1][Branch2][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][#N][C][C][O][Ring1][S]
|
C3(=O)CCCC(C)(C)C#N.[C@@H]17CN3CCO1.c16cnc5s1.C[C@H]47.C26=O.N5(C)C.N24
|
C[C@H](Cc1cccc(Cl)c1)NC(=O)N1CC[C@H](C)C2(CCCCC2)C1
|
C[C@H]CcccccCl)c6)))))))NC=O)NCC[C@H]C)CCCCCC6)))))C6
|
[C][C@H1][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][Ring1][N]
|
N14CC[C@H](C)C2(CCCCC2)C1.c16cccc(Cl)c1.C[C@@H]5C6.C34=O.N35
|
Cc1cc(F)ccc1C(=O)N1CC[C@@H](O)[C@@H](C(=O)Nc2ncc(F)cn2)C1
|
CcccF)ccc6C=O)NCC[C@@H]O)[C@@H]C=O)NcnccF)cn6))))))))C6
|
[C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][O][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][Ring1][P]
|
Cc1cc(F)ccc17.N13CC[C@@H](O)[C@@H]6C1.c15ncc(F)cn1.C37=O.C46=O.N45
|
CCc1cccc(F)c1NC(=O)[C@@H]1[C@H]2CC[C@H](C2)[C@@H]1NC(=O)c1cn[nH]c1
|
CCcccccF)c6NC=O)[C@@H][C@H]CC[C@H]C5)[C@@H]6NC=O)ccn[nH]c5
|
[C][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][C@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][Branch1][C@@H1][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=N][NH1][C][=Ring1][Branch1]
|
c19cccc(F)c15.[C@@H]17[C@H]2CC[C@H](C2)[C@@H]16.c18cn[nH]c1.C37=O.C48=O.CC9.N35.N46
|
C=CCCSCCNC(=O)CN(C(=O)c1nccc2cc[nH]c12)C(C)C
|
C=CCCSCCNC=O)CNC=O)cnccccc[nH]c95))))))))))CC)C
|
[C][=C][C][C][S][C][C][N][C][=Branch1][C][=O][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][C][=C][C][C][=C][NH1][C][Ring1][=Branch2][=Ring1][Branch1][C][Branch1][C][C][C]
|
c1%10nccc2cc[nH]c12.C=CCC8.C3(=O)C6.C9C5.N467.C4%10=O.C7(C)C.S89.N35
|
O=C(N[C@H]1C[C@@H]1NC(=O)[C@@H](O)Cn1cncn1)c1cc(Cl)c(F)cc1F
|
O=CN[C@H]C[C@@H]3NC=O)[C@@H]O)Cncncn5)))))))))))))cccCl)cF)cc6F
|
[O][=C][Branch2][Ring1][Branch2][N][C@H1][C][C@@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][Branch1][C][Cl][=C][Branch1][C][F][C][=C][Ring1][Branch2][F]
|
c16cc(Cl)c(F)cc1F.C3(=O)[C@@H](O)C7.n17cncn1.[C@H]14C[C@@H]15.O=C26.N24.N35
|
C[C@@H](C(=O)NC[C@@H](CO)CNC(=O)C1=CNC2=NCCC2=C1)n1cnnn1
|
C[C@@H]C=O)NC[C@@H]CO))CNC=O)C=CNC=NCCC5=C9))))))))))))))))ncnnn5
|
[C][C@@H1][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][N][C][=N][C][C][C][Ring1][Branch1][=C][Ring1][=Branch2][N][C][=N][N][=N][Ring1][Branch1]
|
C4(=O)C1=CNC2=NCCC2=C1.C5[C@H](C6)CO.C[C@H]7C3=O.n17cnnn1.N35.N46
|
Cc1cscc1C(=O)N1C[C@H](NC(=O)c2ccc3nonc3c2)[C@@H]2CCC[C@H]21
|
Cccscc5C=O)NC[C@H]NC=O)ccccnonc5c9)))))))))))[C@@H]CCC[C@H]58
|
[C][C][=C][S][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][C][=N][O][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C@@H1][C][C][C][C@H1][Ring1][Branch1][Ring2][Ring1][Ring2]
|
N14C[C@H]6[C@@H]2CCC[C@H]21.c18ccc2nonc2c1.Cc1cscc17.C47=O.C58=O.N56
|
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