SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
C=CCC1(C(=O)NCCOCCC(=O)N2CCC[C@H]3[C@H](O)C[C@H]32)CC=CC1
|
C=CCCC=O)NCCOCCC=O)NCCC[C@H][C@H]O)C[C@H]48))))))))))))))))CC=CC5
|
[C][=C][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][O][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][C@H1][Branch1][C][O][C][C@H1][Ring1][Branch1][Ring1][=Branch2][C][C][=C][C][Ring2][Ring1][Branch2]
|
N15CCC[C@H]2[C@H](O)C[C@H]21.C19%10CC=CC1.C7CC5=O.C=CC%10.C49=O.C8C6.N48.O67
|
Cc1sccc1C(=O)N1C[C@H]2C[C@H]1C[C@@H]2NC(=O)c1cnc(O)o1
|
Ccsccc5C=O)NC[C@H]C[C@H]5C[C@@H]5NC=O)ccncO)o5
|
[C][C][S][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][O][O][Ring1][=Branch1]
|
N13C[C@H]2C[C@H]1C[C@@H]25.Cc1sccc17.c16cnc(O)o1.C37=O.C46=O.N45
|
CC[C@@H](OC)C(=O)NC(C)(C)CCNC(=O)c1csc(-c2ccc(OC)cc2)n1
|
CC[C@@H]OC))C=O)NCC)C)CCNC=O)ccsc-ccccOC))cc6))))))n5
|
[C][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=N][Ring1][=N]
|
c1%10ccc6cc1.CC[C@@H]5C3=O.C7(C)(C)CC8.c19csc%10n1.C49=O.O5C.N37.N48.O6C
|
O=C(CC1CC1)N1CC[C@H]2CO[C@@H](CC(=O)N3CCCC(F)(F)[C@H](F)C3)[C@H]2C1
|
O=CCCCC3))))NCC[C@H]CO[C@@H]CC=O)NCCCCF)F)[C@H]F)C7)))))))))[C@H]5C9
|
[O][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][C][C][C@H1][C][O][C@@H1][Branch2][Ring1][Branch2][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C@H1][Branch1][C][F][C][Ring1][#Branch2][C@H1][Ring2][Ring1][C][C][Ring2][Ring1][=Branch1]
|
N14CC[C@H]2CO[C@@H]6[C@H]2C1.N15CCCC(F)(F)[C@H](F)C1.O=C4C7.C6C5=O.C17CC1
|
CSc1ccc(C(=O)NC[C@@H]2[C@H](C)CCN2C(=O)c2ccc(C(N)=O)[nH]2)c(Cl)c1
|
CSccccC=O)NC[C@@H][C@H]C)CCN5C=O)ccccCN)=O))[nH]5))))))))))))))cCl)c6
|
[C][S][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C@@H1][C@H1][Branch1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][NH1][Ring1][Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][O]
|
c1%10ccc8c(Cl)c1.[C@@H]19[C@H](C)CCN14.c16ccc7[nH]1.C38=O.C46=O.C7(N)=O.CS%10.N35.C59
|
Cc1csc(C(=O)NC[C@]2(F)C[C@H](NC(=O)[C@H]3C[C@H](C)OC3=O)C2)c1Cl
|
CccscC=O)NC[C@]F)C[C@H]NC=O)[C@H]C[C@H]C)OC5=O))))))))C4)))))))c5Cl
|
[C][C][=C][S][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][F][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@H1][C][C@H1][Branch1][C][C][O][C][Ring1][=Branch1][=O][C][Ring1][#C][=C][Ring2][Ring1][Branch2][Cl]
|
Cc1csc8c1Cl.[C@H]19C[C@H](C)OC1=O.[C@]1%10(F)C[C@@H]7C1.C48=O.C59=O.N46.C6%10.N57
|
CC#CC[C@@H](C)NC(=O)CN(CCOC)C(=O)c1cccc(C#N)c1
|
CC#CC[C@@H]C)NC=O)CNCCOC))))C=O)cccccC#N))c6
|
[C][C][#C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][Branch1][Branch1][C][C][O][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2]
|
c18cccc(C#N)c1.CC#CC[C@H]5C.C2(=O)C6.N367.C7C4.C38=O.N25.O4C
|
CO[C@@H](CNC(=O)c1cc(N2CCCCC2)ccn1)CNC(=O)[C@@H](O)CCSC
|
CO[C@@H]CNC=O)cccNCCCCC6))))))ccn6)))))))))CNC=O)[C@@H]O)CCSC
|
[C][O][C@@H1][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][=C][C][=N][Ring1][N][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][S][C]
|
c1%10cc9ccn1.C4(=O)[C@@H](O)CC8.N19CCCCC1.[C@H]5(C6)C7.C3%10=O.CO5.N36.N47.S8C
|
C#CC[C@@H](C)C(=O)N(C)C[C@@H](C)N(C)C(=O)c1cncc(Cl)c1C
|
C#CC[C@@H]C)C=O)NC)C[C@@H]C)NC)C=O)ccnccCl)c6C
|
[C][#C][C][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][N][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C]
|
c16cncc(Cl)c1C.C#CC[C@@H](C)C2=O.C4[C@H]5C.N24C.N35C.C36=O
|
Cc1oc(Cl)nc1C(=O)N1C[C@@H](C)N(C(=O)[C@@H](O)c2ccnn2C)[C@@H](C)C1
|
CcocCl)nc5C=O)NC[C@@H]C)NC=O)[C@@H]O)cccnn5C))))))))[C@@H]C)C6
|
[C][C][O][C][Branch1][C][Cl][=N][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][=N][N][Ring1][Branch1][C][C@@H1][Branch1][C][C][C][Ring2][Ring1][C]
|
N13C[C@@H](C)N4[C@@H](C)C1.Cc1oc(Cl)nc15.c16ccnn1C.C4(=O)[C@H]6O.C35=O
|
CCSc1ccccc1C(=O)N[C@H]1C[C@](F)(CNC(=O)C[C@@H]2CN(C)C[C@H]2O)C1
|
CCScccccc6C=O)N[C@H]C[C@]F)CNC=O)C[C@@H]CNC)C[C@H]5O))))))))))C4
|
[C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C@][Branch1][C][F][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@@H1][C][N][Branch1][C][C][C][C@H1][Ring1][=Branch1][O][C][Ring1][P]
|
c1%11ccccc18.[C@@H]1%10CN(C)C[C@H]1O.[C@H]17C[C@@]9(F)C1.C4(=O)C%10.C38=O.CC6.S6%11.N37.C59.N45
|
C=CC[C@H](OC)C(=O)N1CCC[C@@H]1C(=O)N[C@H](CC)C(F)(F)F
|
C=CC[C@H]OC))C=O)NCCC[C@@H]5C=O)N[C@H]CC))CF)F)F
|
[C][=C][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C=CC[C@H]4C2=O.[C@@H]5(CC)C(F)(F)F.N12CCC[C@@H]16.C36=O.O4C.N35
|
OCc1nnc(CCNC(=NCC#Cc2ccccc2)NC[C@H]2CCCO2)s1
|
OCcnncCCNC=NCC#Ccccccc6))))))))))NC[C@H]CCCO5)))))))))))s5
|
[O][C][C][=N][N][=C][Branch2][Ring1][N][C][C][N][C][=Branch1][=N][=N][C][C][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C@H1][C][C][C][O][Ring1][Branch1][S][Ring2][Ring1][#Branch2]
|
N3C(=NCC#Cc1ccccc1)N4.c16nnc7s1.[C@H]15CCCO1.C7C3.OC6.C45
|
COc1ccc(F)cc1CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)COC(C)=O)[C@@H]2C1
|
COccccF)cc6CC=O)NC[C@@H]CCC[C@H]NC=O)COCC)=O))))))[C@@H]6C9
|
[C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][=O][C@@H1][Ring1][=C][C][Ring1][P]
|
N14C[C@@H]2CCC[C@H]8[C@@H]2C1.c17ccc(F)cc19.C9C4=O.C5(=O)C6.C3(C)=O.CO7.N58.O36
|
COc1ccsc1C(=O)N[C@H]1C[C@@H](CO)N(C(=O)[C@H]2CNC(=O)C2)C1
|
COcccsc5C=O)N[C@H]C[C@@H]CO))NC=O)[C@H]CNC=O)C5))))))C5
|
[C][O][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][Ring1][C][O][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][C][Ring1][=Branch1][C][Ring1][#C]
|
[C@H]16C[C@@H]9N4C1.c15ccsc17.[C@H]18CNC(=O)C1.C37=O.C48=O.CO5.N36.C9O
|
Cc1nccn1CC(=O)N[C@@H]1COC2(C1)CN(Cc1csc(Br)c1)C2
|
Ccnccn5CC=O)N[C@@H]COCC5)CNCccscBr)c5))))))C4
|
[C][C][=N][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][N][C][C][=C][S][C][Branch1][C][Br][=C][Ring1][=Branch1][C][Ring1][N]
|
[C@@H]15COC2(C1)CN4C2.Cc1nccn16.c17csc(Br)c1.C6C3=O.N35.C47
|
CC(C)(NC(=O)c1cnn(C2CCC2)c1)c1cn([C@@H]2C3C[C@@H]4C2[C@@H]4C3)nn1
|
CCC)NC=O)ccnnCCCC4))))c5)))))))ccn[C@@H]CC[C@@H]C5[C@@H]3C6)))))))nn5
|
[C][C][Branch1][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][=Ring1][=Branch2][C][=C][N][Branch1][=C][C@@H1][C][C][C@@H1][C][Ring1][Branch1][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][N][=N][Ring1][N]
|
[C@@H]1%10C2C[C@@H]3C1[C@@H]3C2.c17cnn9c1.c18cn%10nn1.CC68C.C19CCC1.C57=O.N56
|
COC(=O)c1ccc(C(=O)N[C@H](C)CNC(=O)/C=C(\F)c2cnn(C)c2)s1
|
COC=O)ccccC=O)N[C@H]C)CNC=O)/C=C\F)ccnnC)c5)))))))))))))s5
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][/C][=C][Branch1][C][\F][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][S][Ring2][Ring1][#Branch1]
|
C=%10(F)c1cnn(C)c1.c18ccc9s1.[C@@H]6(C)C7.C5(=O)C=%10.C38=O.C49=O.CO3.N46.N57
|
Cc1ccc(CC2CCN(N3CC4(CCC4)C3)CC2)cc1
|
CccccCCCCNNCCCCC4)))C4))))CC6)))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][C][C][C][N][Branch1][=C][N][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch1][C][C][Ring1][=N][C][=C][Ring2][Ring1][Ring2]
|
C15CCN(N2CC3(CCC3)C2)CC1.Cc1ccc6cc1.C56
|
C#CC[C@]1(O)C[C@@H](C(=O)NC[C@H](O)CN(C)C(=O)C2=C(CC)OCCC2)C1
|
C#CC[C@]O)C[C@@H]C=O)NC[C@H]O)CNC)C=O)C=CCC))OCCC6)))))))))))))C4
|
[C][#C][C][C@][Branch1][C][O][C][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][Branch1][Ring1][C][C][O][C][C][C][Ring1][Branch2][C][Ring2][Ring1][Branch2]
|
C4(=O)C1=C(CC)OCCC1.[C@]18(O)C[C@H]7C1.C5[C@H](O)C6.C#CC8.C37=O.N46C.N35
|
CC(C)[C@H](C)C(=O)NCC1[C@H]2CN(C(=O)c3cc(-c4cccs4)[nH]n3)C[C@H]12
|
CCC)[C@H]C)C=O)NCC[C@H]CNC=O)ccc-ccccs5)))))[nH]n5))))))C[C@H]65
|
[C][C][Branch1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][NH1][N][=Ring1][#Branch2][C][C@H1][Ring2][Ring1][C][Ring1][P]
|
CC(C)[C@H](C)C5=O.C19[C@H]2CN6C[C@H]12.c18cc%10[nH]n1.c1%10cccs1.C68=O.N57.C79
|
Cc1cc(C(=O)NC[C@@H]2OCC[C@@H]2C(=O)NC[C@H](C)OCCO)sn1
|
CcccC=O)NC[C@@H]OCC[C@@H]5C=O)NC[C@H]C)OCCO))))))))))))))))sn5
|
[C][C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@@H1][O][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][O][C][C][O][S][N][=Ring2][Ring1][Branch2]
|
Cc1cc9sn1.[C@@H]1%11OCC[C@@H]1%10.C8[C@@H]5C.C39=O.C4%10=O.C6CO.N37.C7%11.N48.O56
|
CC(C)(C)[C@H](O)C(=O)N[C@H]1CCC[C@@H]1CNC(=O)C[C@@H]1CCOC1=O
|
CCC)C)[C@H]O)C=O)N[C@H]CCC[C@@H]5CNC=O)C[C@@H]CCOC5=O
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][O][C][Ring1][Branch1][=O]
|
CC(C)(C)[C@H](O)C2=O.[C@H]15CCC[C@@H]16.[C@@H]17CCOC1=O.C3(=O)C7.N25.C46.N34
|
O=C(O)[C@@H](F)C[C@@H]1CCN1C(=O)C1(Cl)CCCCC1
|
O=CO)[C@@H]F)C[C@@H]CCN4C=O)CCl)CCCCC6
|
[O][=C][Branch1][C][O][C@@H1][Branch1][C][F][C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][Cl][C][C][C][C][C][Ring1][#Branch1]
|
C13(Cl)CCCCC1.O=C(O)[C@@H](F)C4.[C@@H]14CCN12.C23=O
|
COC(=O)c1cc(C#N)cnc1NC[C@@H](C)N(C)C(=O)C[C@@H]1CCCOC1
|
COC=O)cccC#N))cnc6NC[C@@H]C)NC)C=O)C[C@@H]CCCOC6
|
[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][#N][=C][N][=C][Ring1][Branch2][N][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C@@H1][C][C][C][O][C][Ring1][=Branch1]
|
c17cc(C#N)cnc16.[C@@H]18CCCOC1.C4[C@H]5C.C3(=O)C8.C27=O.N35C.CO2.N46
|
COC[C@H](OC)C(=O)N1[C@@H]2CCC[C@@H]2[C@H]1CC(=O)NCCS(N)(=O)=O
|
COC[C@H]OC))C=O)N[C@@H]CCC[C@@H]5[C@H]7CC=O)NCCSN)=O)=O
|
[C][O][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C@H1][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][S][Branch1][C][N][=Branch1][C][=O][=O]
|
N13[C@H]8[C@H]2CCC[C@H]21.C5[C@H]6C3=O.C7CS(N)(=O)=O.C8C4=O.CO5.O6C.N47
|
CN(C[C@@H]1C[C@H](F)CN1C(=O)C1CC(C)(C)C1)C(=O)[C@@H]1CC=CCC1
|
CNC[C@@H]C[C@H]F)CN5C=O)CCCC)C)C4)))))))))))C=O)[C@@H]CC=CCC6
|
[C][N][Branch2][Ring1][N][C][C@@H1][C][C@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][=C][C][C][Ring1][=Branch1]
|
[C@@H]17C[C@H](F)CN12.C15CC(C)(C)C1.[C@@H]16CC=CCC1.CN34.C25=O.C36=O.C47
|
CCc1c(C(=O)NCC[C@H]2CCCN2C(=O)[C@H]2CNC(=O)N2C)nnn1C
|
CCccC=O)NCC[C@H]CCCN5C=O)[C@H]CNC=O)N5C))))))))))))))))nnn5C
|
[C][C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][N][Ring1][=Branch1][C][N][=N][N][Ring2][Ring1][Branch2][C]
|
c19c7nnn1C.[C@H]16CNC(=O)N1C.[C@H]18CCCN14.C37=O.C5C8.C46=O.CC9.N35
|
CS[C@@H](C)CCC(=O)N[C@H]1CCC[C@@H]1CNC(=O)c1ccc(F)c(C)c1
|
CS[C@@H]C)CCC=O)N[C@H]CCC[C@@H]5CNC=O)ccccF)cC)c6
|
[C][S][C@@H1][Branch1][C][C][C][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][F][C][Branch1][C][C][=C][Ring1][Branch2]
|
c17ccc(F)c(C)c1.[C@H]5(C)CCC2=O.[C@H]16CCC[C@@H]18.C37=O.CS5.N26.C48.N34
|
Cc1cccc([C@]2(F)CCN(C(=O)NCCC(=O)NCc3cccnc3)C2)c1
|
Cccccc[C@]F)CCNC=O)NCCC=O)NCccccnc6)))))))))))))C5)))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Ring2][C@][Branch1][C][F][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][O]
|
Cc1cccc%10c1.[C@@]1%10(F)CCN4C1.c19cccnc1.C7CC6=O.C45=O.N57.N68.C89
|
O=C(N[C@@H](C(=O)O)C1CCCCC1)c1ccc(COC2CC2)cc1
|
O=CN[C@@H]C=O)O))CCCCCC6))))))))ccccCOCCC3)))))cc6
|
[O][=C][Branch2][Ring1][C][N][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][Branch1][Branch2][C][O][C][C][C][Ring1][Ring1][C][=C][Ring1][O]
|
c17ccc9cc1.C18CCCCC1.[C@@H]68C(=O)O.O=C37.C15CC1.N36.C49.O45
|
CC[C@](C)(CO)C(=O)NCCC1(C)CCN(C(=O)COCc2ccncc2)CC1
|
CC[C@]C)CO))C=O)NCCCC)CCNC=O)COCcccncc6))))))))))CC6
|
[C][C][C@][Branch1][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][O][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][C]
|
CC[C@](C)(CO)C3=O.C18(C)CCN4CC1.c19ccncc1.C4(=O)C5.C7C8.N37.O56.C69
|
CS[C@H](C)CC(=O)N1CC[C@H](C)[C@H](NC(=O)c2cnnn2C2CC2)C1
|
CS[C@H]C)CC=O)NCC[C@H]C)[C@H]NC=O)ccnnn5CCC3))))))))))C6
|
[C][S][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][N][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][C]
|
N13CC[C@H](C)[C@H]6C1.[C@@H]5(C)CC3=O.c17cnnn18.C47=O.C18CC1.CS5.N46
|
O=C(C[C@@H]1COCCN1C(=O)C1CC2(C1)CC2(F)F)NOC1CC1
|
O=CC[C@@H]COCCN6C=O)CCCC4)CC3F)F))))))))))))))NOCCC3
|
[O][=C][Branch2][Ring1][=C][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Ring1][Ring2][Branch1][C][F][F][N][O][C][C][C][Ring1][Ring1]
|
C15CC2(C1)CC2(F)F.[C@@H]16COCCN13.O=C(C6)NO4.C35=O.C14CC1
|
Cc1nc2cncc(C(=O)N[C@@H](C)[C@]3(O)CCN(c4ncc(O)cn4)C3)c2[nH]1
|
CcnccnccC=O)N[C@@H]C)[C@]O)CCNcnccO)cn6))))))C5))))))))c6[nH]9
|
[C][C][=N][C][=C][N][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@][Branch1][C][O][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][O][C][=N][Ring1][#Branch1][C][Ring1][=N][=C][Ring2][Ring1][Branch2][NH1][Ring2][Ring1][O]
|
Cc1nc2cncc8c2[nH]1.[C@@]19(O)CCN7C1.c17ncc(O)cn1.C58=O.[C@@H]69C.N56
|
C=CCCC1(C(=O)N2CC3CC(C(=O)N4CCC(C)(C)CC4)(C3)C2)CC1
|
C=CCCCC=O)NCCCCC=O)NCCCC)C)CC6)))))))C4)C6)))))))CC3
|
[C][=C][C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2][Branch1][Ring2][C][Ring1][=C][C][Ring1][P][C][C][Ring2][Ring1][=Branch1]
|
N15CC2CC8(C2)C1.N16CCC(C)(C)CC1.C=CCC9.C179CC1.C57=O.C68=O
|
O=C(/C=C/c1cnc[nH]1)NC[C@@H]1[C@H]2C[C@@H]1N(C(=O)[C@]1(CO)CCCO1)C2
|
O=C/C=C/ccnc[nH]5)))))))NC[C@@H][C@H]C[C@@H]4NC=O)[C@]CO))CCCO5))))))C5
|
[O][=C][Branch1][#Branch2][/C][=C][/C][=C][N][=C][NH1][Ring1][Branch1][N][C][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch1][S][C][=Branch1][C][=O][C@][Branch1][Ring1][C][O][C][C][C][O][Ring1][#Branch1][C][Ring1][=C]
|
[C@@H]19[C@H]2C[C@@H]1N4C2.C=7c1cnc[nH]1.[C@@]168CCCO1.O=C3C=7.C46=O.N35.C59.C8O
|
O=C(NC[C@H]1C[C@H]1CC(=O)N1CC[C@@H](C2CCC2)C1)c1ccccc1C1CC1
|
O=CNC[C@H]C[C@H]3CC=O)NCC[C@@H]CCCC4))))C5))))))))))))cccccc6CCC3
|
[O][=C][Branch2][Ring1][N][N][C][C@H1][C][C@H1][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
N14CC[C@@H](C2CCC2)C1.c16ccccc19.[C@H]17C[C@H]18.C8C4=O.O=C36.C19CC1.N35.C57
|
CSC[C@H](C)C(=O)N[C@H](CO)CNC(=O)c1cc(-c2cccnc2)on1
|
CSC[C@H]C)C=O)N[C@H]CO))CNC=O)ccc-ccccnc6))))))on5
|
[C][S][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][O][N][=Ring1][O]
|
C7[C@H](C)C3=O.c18cc9on1.c19cccnc1.[C@H]5(C6)CO.C48=O.CS7.N35.N46
|
CC(C)N(C(=O)c1cc2cnc(Cl)cc2s1)C1CCOCC1
|
CCC)NC=O)ccccncCl)cc6s9))))))))))CCCOCC6
|
[C][C][Branch1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][C][C][C][O][C][C][Ring1][=Branch1]
|
c16cc2cnc(Cl)cc2s1.C15CCOCC1.CC4C.N345.C36=O
|
CC(C)c1cccc(C(=O)Nc2ccc(O)cc2I)c1
|
CCC)cccccC=O)NccccO)cc6I)))))))))c6
|
[C][C][Branch1][C][C][C][=C][C][=C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][I][=C][Ring1][P]
|
c14ccc(O)cc1I.c16cccc5c1.CC6C.C35=O.N34
|
CC(C)[C@](C)(O)C(=O)NC[C@@H]1CCCN1C(=O)C(C)(C)CN1CCOCC1
|
CCC)[C@]C)O)C=O)NC[C@@H]CCCN5C=O)CC)C)CNCCOCC6
|
[C][C][Branch1][C][C][C@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][N][C][C][O][C][C][Ring1][=Branch1]
|
CC(C)[C@](C)(O)C2=O.C3(=O)C(C)(C)C5.[C@@H]16CCCN13.N15CCOCC1.N24.C46
|
COCc1ccsc1C(=O)N[C@H]1C[C@@H]1NC(=O)C1CCN(C(C)=O)CC1
|
COCcccsc5C=O)N[C@H]C[C@@H]3NC=O)CCCNCC)=O))CC6
|
[C][O][C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][=Branch2]
|
C19CCN4CC1.c1%10ccsc18.[C@H]16C[C@@H]17.C28=O.C39=O.C4(C)=O.CO5.C5%10.N26.N37
|
C[C@@H]1C[C@H](NC(=O)c2sccc2OC(F)F)CN1C(=O)Cc1nc(C2CC2)n[nH]1
|
C[C@@H]C[C@H]NC=O)csccc5OCF)F))))))))))CN5C=O)CcncCCC3)))n[nH]5
|
[C][C@@H1][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][O][C][Branch1][C][F][F][C][N][Ring1][P][C][=Branch1][C][=O][C][C][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][NH1][Ring1][Branch2]
|
C[C@@H]1C[C@H]6CN14.c17sccc15.c18nc9n[nH]1.O5C(F)F.C4(=O)C8.C37=O.C19CC1.N36
|
C[C@@H](C#N)C(=O)N[C@@H]1CCC[C@@]1(C)CNC(=O)c1cc(C2CCOCC2)no1
|
C[C@@H]C#N))C=O)N[C@@H]CCC[C@@]5C)CNC=O)cccCCCOCC6))))))no5
|
[C][C@@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][=N][O][Ring1][O]
|
[C@@H]16CCC[C@]18C.C[C@@H](C#N)C3=O.c17cc9no1.C19CCOCC1.C47=O.N36.C58.N45
|
CCCN1CCCC[C@@H]1C(=O)N1C[C@H]2CCN(C(=O)C=C(C)C(C)C)[C@H]2C1
|
CCCNCCCC[C@@H]6C=O)NC[C@H]CCNC=O)C=CC)CC)C)))))[C@H]5C8
|
[C][C][C][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][Branch1][C][C][C][C@H1][Ring1][=N][C][Ring1][S]
|
N13C[C@H]2CCN4[C@H]2C1.N15CCCC[C@@H]16.C=7(C)C(C)C.C4(=O)C=7.CCC5.C36=O
|
C#CC[C@](C)(CC)C(=O)N1CCC[C@H](N(CCO)C(=O)CCC=C=C)C1
|
C#CC[C@]C)CC))C=O)NCCC[C@H]NCCO)))C=O)CCC=C=C)))))))C6
|
[C][#C][C][C@][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][S][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C][C][C][=C][=C][C][Ring1][P]
|
C#CC[C@](C)(CC)C2=O.N12CCC[C@H]5C1.C3(=O)CCC=C=C.N345.C4CO
|
Cc1ccsc1CC(=O)NCCCN(C)C(=O)[C@@H]1CCc2nnc(O)cc2C1
|
Ccccsc5CC=O)NCCCNC)C=O)[C@@H]CCcnncO)cc6C%10
|
[C][C][C][=C][S][C][=Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C][=N][N][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][Ring1][O]
|
[C@@H]17CCc2nnc(O)cc2C1.Cc1ccsc18.C8C3=O.C5CC6.N46C.C47=O.N35
|
CO[C@H](C(=O)N1CCC[C@@H](NC(=O)CCc2nc(C)c(C)[nH]2)C1)C1CCCCC1
|
CO[C@H]C=O)NCCC[C@@H]NC=O)CCcncC)cC)[nH]5)))))))))C6)))))))CCCCCC6
|
[C][O][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][=N][C][Branch1][C][C][=C][Branch1][C][C][NH1][Ring1][#Branch1][C][Ring2][Ring1][C][C][C][C][C][C][C][Ring1][=Branch1]
|
N13CCC[C@@H]6C1.c17nc(C)c(C)[nH]1.C18CCCCC1.[C@H]58C3=O.C4(=O)CC7.CO5.N46
|
O=C(NC[C@H]1CCCN1C(=O)Cc1cccc2sccc12)c1cccc(O)c1F
|
O=CNC[C@H]CCCN5C=O)Ccccccsccc95))))))))))))))))))cccccO)c6F
|
[O][=C][Branch2][Ring1][N][N][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][F]
|
c18cccc2sccc12.c16cccc(O)c1F.[C@H]17CCCN14.C4(=O)C8.O=C36.N35.C57
|
CCCCS(=O)(=O)N1CCCN(C(=O)C(=O)NC[C@](C)(CC2CCC2)OC)CC1
|
CCCCS=O)=O)NCCCNC=O)C=O)NC[C@]C)CCCCC4)))))OC)))))))CC7
|
[C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][O][C][C][C][Ring2][Ring1][=Branch1]
|
N17CCCN3CC1.CCCCS7(=O)=O.C6[C@]5(C)C8.C3(=O)C4=O.C18CCC1.N46.O5C
|
CN(C)[C@@H](CN=c1nc(N2C[C@H]3CC[C@@H](C2)N3C)c2c([nH]1)CCS2)C1CC1
|
CNC)[C@@H]CN=cncNC[C@H]CC[C@@H]C7)N5C))))))))cc[nH]6)CCS5))))))))))CCC3
|
[C][N][Branch1][C][C][C@@H1][Branch2][Ring2][Ring1][C][N][=C][N][=C][Branch1][S][N][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][C][=C][Branch1][Ring2][NH1][Ring1][#C][C][C][S][Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
[C@@H]46CN=c1nc5c2c([nH]1)CCS2.N15C[C@H]2CC[C@@H](C1)N2C.CN4C.C16CC1
|
COc1ccc(C)c(C(=O)N2CC[C@](C)(NC(=O)CN3CC[C@](C)(O)C3)C2)n1
|
COccccC)cC=O)NCC[C@]C)NC=O)CNCC[C@]C)O)C5))))))))C5))))))n6
|
[C][O][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][N][C][C][C@][Branch1][C][C][Branch1][C][O][C][Ring1][#Branch1][C][Ring1][P][=N][Ring2][Ring1][#Branch2]
|
c16ccc(C)c9n1.N14CC[C@@]7(C)C1.N18CC[C@](C)(O)C1.C5(=O)C8.C49=O.CO6.N57
|
CN1CCCCC[C@@H]1C(=O)NC1(C(=O)NCCC[C@@H]2CCC[C@H]2O)CSC1
|
CNCCCCC[C@@H]7C=O)NCC=O)NCCC[C@@H]CCC[C@H]5O)))))))))))CSC4
|
[C][N][C][C][C][C][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][C@@H1][C][C][C][C@H1][Ring1][Branch1][O][C][S][C][Ring1][S]
|
CN1CCCCC[C@@H]17.[C@@H]19CCC[C@H]1O.C158CSC1.C6CC9.C37=O.C48=O.N35.N46
|
COc1cc(C)ccc1C(=O)NC[C@H](C1CC1)N(C)C(=O)[C@H]1OCC1(C)C
|
COcccC)ccc6C=O)NC[C@H]CCC3)))NC)C=O)[C@H]OCC4C)C
|
[C][O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][O][C][C][Ring1][Ring2][Branch1][C][C][C]
|
c14cc(C)ccc18.[C@H]17OCC1(C)C.C5[C@@H]69.C28=O.C19CC1.N36C.C37=O.CO4.N25
|
Cc1ccc(C(=O)N2C[C@@H](NC(=O)c3ccnn3C3CC3)C[C@@H]2C)c(O)c1
|
CccccC=O)NC[C@@H]NC=O)cccnn5CCC3))))))))))C[C@@H]5C)))))))cO)c6
|
[C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][C@@H1][Ring1][S][C][C][Branch1][C][O][=C][Ring2][Ring1][#Branch2]
|
Cc1ccc8c(O)c1.N14C[C@@H]6C[C@@H]1C.c17ccnn19.C48=O.C57=O.C19CC1.N56
|
CC(=O)OCCC(=O)NCCn1cc(C(=O)N(C)[C@@H](C)C(N)=O)nn1
|
CC=O)OCCC=O)NCCnccC=O)NC)[C@@H]C)CN)=O)))))nn5
|
[C][C][=Branch1][C][=O][O][C][C][C][=Branch1][C][=O][N][C][C][N][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][Branch1][C][N][=O][N][=N][Ring1][=C]
|
n19cc8nn1.C5CC3=O.[C@H]7(C)C(N)=O.CC2=O.C6C9.C48=O.N47C.O25.N36
|
C[C@H](C(=O)N(CCO)[C@@H]1CCCN(C(=O)c2ccncn2)C1)N1CCCCCC1
|
C[C@H]C=O)NCCO)))[C@@H]CCCNC=O)cccncn6)))))))C6))))))))NCCCCCC7
|
[C][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C@@H1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][C][=N][Ring1][=Branch1][C][Ring1][=C][N][C][C][C][C][C][C][Ring1][#Branch1]
|
[C@@H]17CCCN4C1.N15CCCCCC1.c18ccncn1.C[C@@H]5C3=O.N367.C6CO.C48=O
|
CCC(CC)[C@H](C)C(=O)N[C@H](CO)CNC(=O)c1ccnn1C1CC1
|
CCCCC))[C@H]C)C=O)N[C@H]CO))CNC=O)cccnn5CCC3
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
CCC(CC)[C@H](C)C2=O.c16ccnn17.[C@H]4(C5)CO.C36=O.C17CC1.N24.N35
|
CCCc1cc(C(=O)N2CCC(C)(C)C[C@@H]2C(=O)N[C@@H]2[C@H]3CCC(F)(F)[C@H]32)n[nH]1
|
CCCcccC=O)NCCCC)C)C[C@@H]6C=O)N[C@@H][C@H]CCCF)F)[C@H]56)))))))))))))))n[nH]5
|
[C][C][C][C][=C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C][C][Branch1][C][F][Branch1][C][F][C@H1][Ring1][#Branch1][Ring1][Branch2][=N][NH1][Ring2][Ring1][#Branch2]
|
N14CCC(C)(C)C[C@@H]17.[C@@H]16[C@H]2CCC(F)(F)[C@@H]12.c19cc8n[nH]1.CCC9.C48=O.C57=O.N56
|
CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@]2(C(F)(F)F)CCC(C)(C)C2)c1
|
CC=O)ccccCl)cS=O)=O)N[C@@]CF)F)F))CCCC)C)C5)))))))c6
|
[C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch2][Ring1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][O][=C][Ring2][Ring1][=Branch1]
|
c15ccc(Cl)c(S4(=O)=O)c1.[C@]136CCC(C)(C)C1.C6(F)(F)F.CC5=O.N34
|
O=C(NC[C@H]1C=CCN1C(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1cccc(OCC(F)F)n1
|
O=CNC[C@H]C=CCN5C=O)[C@@H]C[C@H]CC[C@@H]6O5)))))))))))))))cccccOCCF)F))))n6
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C@H1][C][C][C@@H1][Ring1][=Branch1][O][Ring1][Branch1][C][=C][C][=C][C][Branch1][Branch2][O][C][C][Branch1][C][F][F][=N][Ring1][O]
|
[C@@H]19C[C@H]2CC[C@@H]1O2.c18cccc6n1.[C@H]1%10C=CCN14.C5C(F)F.O=C38.C49=O.N37.C7%10.O56
|
C=CCn1nnnc1[C@@H](CCCSC)N[C@H]1CCCC(F)(F)C1
|
C=CCnnnnc5[C@@H]CCCSC)))))N[C@H]CCCCF)F)C6
|
[C][=C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][=Branch1][C][C][C][S][C][N][C@H1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2]
|
[C@H]14CCCC(F)(F)C1.n15nnnc16.[C@H]26CCC3.C=CC5.S3C.N24
|
C#Cc1ccc(C(=O)NCC[C@H](C)NC(=O)[C@H](C)Sc2ccc(F)cc2)o1
|
C#CccccC=O)NCC[C@H]C)NC=O)[C@H]C)SccccF)cc6)))))))))))))))o5
|
[C][#C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][S][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][Ring2][Ring1][=Branch2]
|
C#Cc1ccc8o1.c19ccc(F)cc1.C5C[C@@H]6C.C4(=O)[C@@H]7C.C38=O.N35.N46.S79
|
CC(C)CCC(=O)N1Cc2ccc(C(=O)N=c3nc[nH]n4cc(Br)cc34)cc2C1
|
CCC)CCC=O)NCccccC=O)N=cnc[nH]nccBr)cc95)))))))))))cc6C9
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][=C][N][=C][NH1][N][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch1]
|
C6(=O)N=c1nc[nH]n2cc(Br)cc12.N15Cc2ccc6cc2C1.CC(C)CCC5=O
|
N#Cc1cnc(N2CC[C@]3(NC(=O)C(N)=O)CCC[C@H]23)c(Cl)c1
|
N#CccncNCC[C@]NC=O)CN)=O))))CCC[C@H]85))))))))cCl)c6
|
[N][#C][C][=C][N][=C][Branch2][Ring1][=Branch2][N][C][C][C@][Branch1][O][N][C][=Branch1][C][=O][C][Branch1][C][N][=O][C][C][C][C@H1][Ring1][=C][Ring1][O][C][Branch1][C][Cl][=C][Ring2][Ring1][Branch1]
|
N#Cc1cnc5c(Cl)c1.N15CC[C@]26CCC[C@H]12.C4(=O)C(N)=O.N46
|
COC[C@@]1(C(=O)N[C@H](C)CNC(=O)CSc2ccc(C)c(C)c2)CC=CCC1
|
COC[C@@]C=O)N[C@H]C)CNC=O)CSccccC)cC)c6))))))))))))))CC=CCC6
|
[C][O][C][C@@][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2][C][C][=C][C][C][Ring2][Ring1][=Branch2]
|
c1%11ccc(C)c(C)c1.[C@@]19%10CC=CCC1.[C@@H]6(C)C7.C4(=O)C8.C39=O.CO5.C5%10.N36.N47.S8%11
|
CCOCCC(=O)N[C@H]1CN(C(=O)Cc2cc(CC)no2)CC[C@H]1C
|
CCOCCC=O)N[C@H]CNC=O)CcccCC))no5)))))))CC[C@H]6C
|
[C][C][O][C][C][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][Branch1][Ring1][C][C][=N][O][Ring1][#Branch1][C][C][C@H1][Ring1][S][C]
|
[C@H]17CN4CC[C@H]1C.c18cc9no1.C6CC3=O.C4(=O)C8.CC5.O56.N37.C9C
|
C[C@H](O)[C@H](C)C(=O)N1C[C@H](CNC(=O)[C@@H]2CC3(CCO2)CC3)[C@@H](N(C)C)C1
|
C[C@H]O)[C@H]C)C=O)NC[C@H]CNC=O)[C@@H]CCCCO6)))CC3))))))))[C@@H]NC)C))C5
|
[C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch1][C@@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring2][Ring1][Ring2]
|
[C@@H]18CC2(CCO1)CC2.C[C@H](O)[C@H](C)C4=O.N14C[C@H]7[C@@H]9C1.C58=O.N7(C)C.C69.N56
|
C[S@@+]([O-])CCC(=O)N1CCOC[C@@H]1CCNC(=O)C(C)(C)COCC(F)F
|
C[S@@+][O-])CCC=O)NCCOC[C@@H]6CCNC=O)CC)C)COCCF)F
|
[C][S@@+1][Branch1][C][O-1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][O][C][C][Branch1][C][F][F]
|
C[S@@+]([O-])CCC2=O.N12CCOC[C@@H]17.C3(=O)C(C)(C)C4.C5C(F)F.C7C6.N36.O45
|
C=CCSc1ccccc1C(=O)N1CCN(C)[C@@H](CNC(=O)[C@@H]2C[C@@H]2C(F)F)C1
|
C=CCScccccc6C=O)NCCNC)[C@@H]CNC=O)[C@@H]C[C@@H]3CF)F))))))))C6
|
[C][=C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][Branch1][C][F][F][C][Ring1][P]
|
N13CCN(C)[C@@H]9C1.c1%11ccccc18.[C@@H]17C[C@@H]1%10.C=CC6.C38=O.C47=O.C%10(F)F.S6%11.C59.N45
|
O=C1C[C@@H](C(=O)N[C@H]2CCN(C(=O)c3ccnc(OC(F)F)c3)C23CCCC3)N1
|
O=CC[C@@H]C=O)N[C@H]CCNC=O)cccncOCF)F)))c6)))))))C5CCCC5)))))))))))N4
|
[O][=C][C][C@@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring1][#Branch2][C][Ring1][P][C][C][C][C][Ring1][Branch1][N][Ring2][Ring1][N]
|
[C@H]17CCN5C12CCCC2.c19ccnc6c1.O=C1C[C@@H]8N1.O6C(F)F.C48=O.C59=O.N47
|
CS(=O)(=O)N1CCN(CC(=O)N2CCN(C(=O)C3CC3)[C@@H](CC3CC3)C2)CC1
|
CS=O)=O)NCCNCC=O)NCCNC=O)CCC3))))[C@@H]CCCC3))))C6))))))))CC6
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C@@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][#C][C][C][Ring2][Ring1][Branch2]
|
N14CCN5[C@@H]9C1.N17CCN6CC1.CS7(=O)=O.C6C4=O.C58=O.C18CC1.C1%10CC1.C9%10
|
C[C@@H]1N(C(=O)[C@@]2(C)C=CCN2C(=O)CCn2cnnn2)CCOC1(C)C
|
C[C@@H]NC=O)[C@@]C)C=CCN5C=O)CCncnnn5))))))))))))))CCOC6C)C
|
[C][C@@H1][N][Branch2][Ring1][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][=C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][N][C][=N][N][=N][Ring1][Branch1][C][C][O][C][Ring2][Ring1][#Branch1][Branch1][C][C][C]
|
C[C@@H]1N3CCOC1(C)C.[C@]15(C)C=CCN14.C4(=O)CC6.n16cnnn1.C35=O
|
COCCN=C(NC[C@H]1C[C@@H](N(C)C)C1)N[C@H](C)c1csnn1
|
COCCN=CNC[C@H]C[C@@H]NC)C))C4))))))N[C@H]C)ccsnn5
|
[C][O][C][C][N][=C][Branch1][S][N][C][C@H1][C][C@@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][#Branch1][N][C@H1][Branch1][C][C][C][=C][S][N][=N][Ring1][Branch1]
|
C2CN=C(N3)N4.[C@H]17C[C@@H]5C1.c16csnn1.N5(C)C.[C@H]46C.CO2.C37
|
Cc1c(CCC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)cnn1C
|
CccCCC=O)N[C@H]C)CNC=O)OCC)C)C)))))))))))cnn5C
|
[C][C][=C][Branch2][Ring1][O][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=N][N][Ring2][Ring1][Branch1][C]
|
Cc1c8cnn1C.C8CC3=O.[C@@H]6(C)C7.C5(C)(C)C.C24=O.N36.N47.O25
|
CC1CCC1C(=O)N1CCC2(CCCN2C(=O)CCOCC2CC2)CC1
|
CCCCC4C=O)NCCCCCCN5C=O)CCOCCCC3))))))))))))CC6
|
[C][C][C][C][C][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][O][C][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][Ring1]
|
N13CCC2(CCCN24)CC1.CC1CCC17.C4(=O)CC5.C37=O.C18CC1.O56.C68
|
CC[C@@H](O)C(=O)N[C@H](C)C(C)(C)NC(=O)CCCn1ccccc1=O
|
CC[C@@H]O)C=O)N[C@H]C)CC)C)NC=O)CCCnccccc6=O
|
[C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][N][C][=C][C][=C][C][Ring1][=Branch1][=O]
|
n16ccccc1=O.CC[C@@H](O)C2=O.[C@@H]4(C)C5(C)C.C3(=O)CCC6.N24.N35
|
CC1(C)CCO[C@H]1C(=O)N[C@](C)(CO)C(=O)NC[C@@H]1[C@H](CO)C1(F)F
|
CCC)CCO[C@H]5C=O)N[C@]C)CO))C=O)NC[C@@H][C@H]CO))C3F)F
|
[C][C][Branch1][C][C][C][C][O][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@][Branch1][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C@@H1][C@H1][Branch1][Ring1][C][O][C][Ring1][Branch1][Branch1][C][F][F]
|
CC1(C)CCO[C@H]16.[C@]4(C)(CO)C3=O.[C@@H]17[C@H]8C1(F)F.C26=O.N24.N35.C57.C8O
|
CCCc1nc(=N[C@@H]2CCC[C@@H]3CN(C(=O)c4occc4C)C[C@H]32)s[nH]1
|
CCCcnc=N[C@@H]CCC[C@@H]CNC=O)coccc5C)))))))C[C@H]59))))))))))s[nH]5
|
[C][C][C][C][=N][C][=Branch2][Ring1][=N][=N][C@@H1][C][C][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][C][C@H1][Ring1][=N][Ring1][P][S][NH1][Ring2][Ring1][#Branch1]
|
c17nc(=N[C@@H]2CCC[C@@H]3CN5C[C@H]32)s[nH]1.c16occc1C.CCC7.C56=O
|
CC(=O)NCCC(=O)NC1C[C@H]2CC[C@@H](C1)N2C(=O)c1coc2cccc(O)c12
|
CC=O)NCCC=O)NCC[C@H]CC[C@@H]C7)N5C=O)ccocccccO)c96
|
[C][C][=Branch1][C][=O][N][C][C][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][O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch2][Ring1][#Branch1]
|
c18coc2cccc(O)c12.C17C[C@H]2CC[C@@H](C1)N25.C6CC4=O.CC3=O.C58=O.N36.N47
|
CC1(C)CCc2c1n[nH]c2C(=O)NC[C@H]1C[C@H]1CNC(=O)C(N)=O
|
CCC)CCcc5n[nH]c5C=O)NC[C@H]C[C@H]3CNC=O)CN)=O
|
[C][C][Branch1][C][C][C][C][C][C][Ring1][=Branch1][=N][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][N][=O]
|
CC1(C)CCc2c1n[nH]c27.C4(=O)C(N)=O.[C@H]18C[C@H]19.C37=O.N35.C58.C69.N46
|
O=C(CC1CCN(C(=O)[C@H]2C[C@@H](O)C2)CC1)Nc1c(Cl)cc(F)cc1Cl
|
O=CCCCCNC=O)[C@H]C[C@@H]O)C4)))))CC6)))))))NccCl)ccF)cc6Cl
|
[O][=C][Branch2][Ring1][=Branch2][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][O][C][Ring1][Branch1][C][C][Ring1][=N][N][C][=C][Branch1][C][Cl][C][=C][Branch1][C][F][C][=C][Ring1][Branch2][Cl]
|
c15c(Cl)cc(F)cc1Cl.C17CCN4CC1.[C@H]16C[C@@H](O)C1.O=C3C7.C46=O.N35
|
CC(C)(C)[C@H]1CN(C(=O)[C@H]2C=CCS2)CCN1C(=O)c1ccc2cnnn2c1
|
CCC)C)[C@H]CNC=O)[C@H]C=CCS5))))))CCN6C=O)cccccnnn5c9
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C@H1][C][=C][C][S][Ring1][Branch1][C][C][N][Ring1][=N][C][=Branch1][C][=O][C][C][=C][C][=C][N][=N][N][Ring1][Branch1][C][=Ring1][=Branch2]
|
c16ccc2cnnn2c1.[C@H]17CN3CCN14.[C@H]15C=CCS1.CC7(C)C.C35=O.C46=O
|
CN(C)C(=O)CCC(=O)N[C@@H]1CN(C(=O)COC(F)(F)F)CC[C@H]1F
|
CNC)C=O)CCC=O)N[C@@H]CNC=O)COCF)F)F)))))CC[C@H]6F
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][Branch1][C][F][Branch1][C][F][F][C][C][C@H1][Ring1][=C][F]
|
[C@@H]16CN4CC[C@H]1F.C2(=O)CCC3=O.O5C(F)(F)F.C4(=O)C5.CN2C.N36
|
CC[C@H](C(=O)NCc1cc(C(=O)N2CCC[C@H]2[C@H]2CCOC2)on1)C(C)C
|
CC[C@H]C=O)NCcccC=O)NCCC[C@H]5[C@H]CCOC5)))))))))))on5))))))))CC)C
|
[C][C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C@H1][C][C][O][C][Ring1][Branch1][O][N][=Ring1][P][C][Branch1][C][C][C]
|
CC[C@H](C3=O)C(C)C.c17cc6on1.N14CCC[C@H]18.[C@H]18CCOC1.C46=O.N35.C57
|
C[C@@H]1CCN(C(=O)CNC(N)=O)C[C@H]1NC(=O)c1cccc2c1CCC(=O)N2
|
C[C@@H]CCNC=O)CNCN)=O)))))C[C@H]6NC=O)cccccc6CCC=O)N6
|
[C][C@@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][N][C][Branch1][C][N][=O][C][C@H1][Ring1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1]
|
c18cccc2c1CCC(=O)N2.C[C@@H]1CCN3C[C@H]17.C3(=O)C6.C4(N)=O.C58=O.N46.N57
|
C=CC[C@H](CC(F)F)C(=O)NCCN(C[C@H](C)O)C(=O)[C@@H](C(C)C)C1CCC1
|
C=CC[C@H]CCF)F)))C=O)NCCNC[C@H]C)O)))C=O)[C@@H]CC)C))CCCC4
|
[C][=C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C@H1][Branch1][C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][C][C][C][Ring1][Ring2]
|
C=CC[C@H](CC(F)F)C2=O.C3(=O)[C@H]7C(C)C.C6[C@H](C)O.C17CCC1.C4C5.N356.N24
|
CCc1nonc1C(=O)N1C[C@@H]2CCN(C(=O)[C@H](C)CC(F)F)C[C@@H]2C1
|
CCcnonc5C=O)NC[C@@H]CCNC=O)[C@H]C)CCF)F)))))C[C@@H]6C9
|
[C][C][C][=N][O][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][Branch1][C][F][F][C][C@@H1][Ring1][=C][C][Ring1][P]
|
N13C[C@@H]2CCN4C[C@@H]2C1.C4(=O)[C@H](C)CC(F)F.c16nonc15.C35=O.CC6
|
CCn1ncnc1C(=O)NC[C@@H]1C[C@@H]1CNC(=O)Cc1cc(F)ccc1O
|
CCnncnc5C=O)NC[C@@H]C[C@@H]3CNC=O)CcccF)ccc6O
|
[C][C][N][N][=C][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O]
|
c1%10cc(F)ccc1O.n17ncnc16.[C@@H]18C[C@@H]19.C3(=O)C%10.C26=O.CC7.N24.C48.C59.N35
|
CC(=O)c1cc(N2CCC[C@@H]2CN(C)C(=O)CN2C[C@H]3C[C@@H]3C2)ncn1
|
CC=O)cccNCCC[C@@H]5CNC)C=O)CNC[C@H]C[C@@H]3C6)))))))))))))))ncn6
|
[C][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][N][N][C][C][C][C@@H1][Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][C@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][=N][C][=N][Ring2][Ring1][#Branch1]
|
c18cc7ncn1.N17CCC[C@@H]19.N16C[C@H]2C[C@@H]2C1.C4(=O)C6.CC8=O.N45C.C59
|
CCOCCCCC(=O)NCC1(C(=O)N2CC(CC(N)=O)C2)CCCC1
|
CCOCCCCC=O)NCCC=O)NCCCCN)=O)))C4)))))CCCC5
|
[C][C][O][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][Ring1][Branch2][C][C][C][C][Ring1][#C]
|
C6CCCC3=O.C189CCCC1.N14CC%10C1.C%10C(N)=O.C48=O.CC5.O56.N37.C79
|
Cc1ccc(CC(=O)NCCOCCCNC(=O)C(=O)Nc2ccccc2)cn1
|
CccccCC=O)NCCOCCCNC=O)C=O)Ncccccc6)))))))))))))))))))cn6
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][C][O][C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][Ring2][Ring1][N]
|
Cc1ccc%11cn1.c1%10ccccc1.C4(=O)C5=O.C%11C3=O.C7CC9.C8C6.N38.O67.N49.N5%10
|
CNS(=O)(=O)CCC(=O)N1CC[C@H]2C[C@H]1CN2C(=O)C[C@@H]1C=CCCC1
|
CNS=O)=O)CCC=O)NCC[C@H]C[C@H]6CN5C=O)C[C@@H]C=CCCC6
|
[C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C@H1][Ring1][=Branch1][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@@H1][C][=C][C][C][C][Ring1][=Branch1]
|
N13CC[C@H]2C[C@H]1CN24.S5(=O)(=O)CCC3=O.[C@@H]16C=CCCC1.C4(=O)C6.CN5
|
COC(=O)[C@@H]1C[C@@H]1C(=O)N(C)CC(C)(C)CNC(=O)c1csc(C)c1C1CC1
|
COC=O)[C@@H]C[C@@H]3C=O)NC)CCC)C)CNC=O)ccscC)c5CCC3
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
c19csc(C)c1%10.C5C(C)(C)C6.[C@@H]17C[C@@H]18.C27=O.C38=O.N35C.C49=O.C1%10CC1.CO2.N46
|
CC(C)CS(=O)(=O)CC(=O)N1CCCN(C(=O)c2cnc(C3CC3)[nH]2)CC1
|
CCC)CS=O)=O)CC=O)NCCCNC=O)ccncCCC3)))[nH]5))))))CC7
|
[C][C][Branch1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][NH1][Ring1][Branch2][C][C][Ring1][P]
|
CC(C)CS(=O)(=O)CC4=O.N14CCCN5CC1.c16cnc7[nH]1.C56=O.C17CC1
|
COC[C@H](NC(=O)[C@@H](C)[C@@H](C)NC(=O)CCCCCC(C)C)C(=O)OC
|
COC[C@H]NC=O)[C@@H]C)[C@@H]C)NC=O)CCCCCCC)C)))))))))))))C=O)OC
|
[C][O][C][C@H1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O][C]
|
C3(=O)CCCCCC(C)C.C2(=O)[C@@H](C)[C@H]6C.C4[C@H]5C1=O.CO4.N25.N36.O1C
|
CCc1scnc1C(=O)N[C@@H](C)[C@H]1CN(C(=O)c2ncoc2C(C)(C)C)CCO1
|
CCcscnc5C=O)N[C@@H]C)[C@H]CNC=O)cncoc5CC)C)C))))))))CCO6
|
[C][C][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][N][=C][O][C][=Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][C][C][O][Ring1][P]
|
[C@H]18CN4CCO1.c19scnc16.c17ncoc1%10.C%10(C)(C)C.C36=O.[C@@H]58C.C47=O.CC9.N35
|
CN1CC[C@H](CN(C)C(=O)[C@@H](CCC2CC2)NC(=O)C[C@@H]2OCCC2(C)C)C1
|
CNCC[C@H]CNC)C=O)[C@@H]CCCCC3)))))NC=O)C[C@@H]OCCC5C)C)))))))))))))C5
|
[C][N][C][C][C@H1][Branch2][Ring2][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][Branch2][C][C][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C][C@@H1][O][C][C][C][Ring1][Branch1][Branch1][C][C][C][C][Ring2][Ring1][O]
|
C3(=O)[C@H]6CC9.[C@@H]17OCCC1(C)C.CN1CC[C@H]8C1.C4(=O)C7.N35C.C19CC1.C58.N46
|
C=CCCC(C)(C)CNC(=O)[C@@]1(F)CCN(C(=O)CC=CC)C1
|
C=CCCCC)C)CNC=O)[C@@]F)CCNC=O)CC=CC)))))C5
|
[C][=C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][F][C][C][N][Branch1][=Branch2][C][=Branch1][C][=O][C][C][=C][C][C][Ring1][N]
|
C=CCCC(C)(C)C4.[C@]15(F)CCN3C1.C3(=O)CC=6.C25=O.N24.C=6C
|
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