SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCn1nc(C(=O)NCCC(F)(F)Cn2cc(C(C)(C)CO)nn2)cc1O
|
CCnncC=O)NCCCF)F)CnccCC)C)CO)))nn5)))))))))))cc5O
|
[C][C][N][N][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][C][N][C][=C][Branch1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][O][N][=N][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch2][O]
|
n16nc5cc1O.C4CC(F)(F)C7.n17cc8nn1.C8(C)(C)CO.C35=O.CC6.N34
|
CO[C@@H]1CC[C@]2(C(=O)NC3(C4CCN(C(=O)[C@H](C)C(C)(C)C)CC4)CC3)C[C@H]12
|
CO[C@@H]CC[C@]C=O)NCCCCNC=O)[C@H]C)CC)C)C))))CC6))))))CC3)))))C[C@H]63
|
[C][O][C@@H1][C][C][C@][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][Branch2][Ring1][O][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=C][C][C][Ring1][P][C][C@H1][Ring2][Ring1][#Branch2][Ring2][Ring1][#Branch1]
|
C18(C2CCN6CC2)CC1.C6(=O)[C@H](C)C(C)(C)C.[C@@H]17CC[C@]29C[C@H]12.C59=O.CO7.N58
|
Cc1nc(C(=O)N[C@@H](CNC(=O)[C@@H](F)C(C)C)CC(C)C)nn1-c1ccccc1
|
CcncC=O)N[C@@H]CNC=O)[C@@H]F)CC)C))))))CCC)C))))))nn5-cccccc6
|
[C][C][=N][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][C][C][C][C][Branch1][C][C][C][=N][N][Ring2][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
Cc1nc6nn17.[C@H]4(C5)CC(C)C.C3(=O)[C@@H](F)C(C)C.c17ccccc1.C26=O.N24.N35
|
N#Cc1ccc(Br)c(C(=O)N2C[C@H]3CN(c4ncnc5sc(Br)cc45)C[C@@H]32)c1
|
N#CccccBr)cC=O)NC[C@H]CNcncncscBr)cc95)))))))))C[C@@H]57))))))))c6
|
[N][#C][C][=C][C][=C][Branch1][C][Br][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][P][C][=N][C][=N][C][S][C][Branch1][C][Br][=C][C][Ring1][#Branch2][=Ring1][=Branch1][C][C@@H1][Ring1][#C][Ring1][P][=C][Ring2][Ring1][#Branch2]
|
c17ncnc2sc(Br)cc12.N#Cc1ccc(Br)c8c1.N16C[C@H]2CN7C[C@@H]21.C68=O
|
CCCCn1nnnc1[C@H](NCCc1ccc(C(F)F)cc1)c1cc(Br)no1
|
CCCCnnnnc5[C@H]NCCccccCF)F))cc6)))))))))cccBr)no5
|
[C][C][C][C][N][N][=N][N][=C][Ring1][Branch1][C@H1][Branch2][Ring1][Ring1][N][C][C][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][F][F][C][=C][Ring1][=Branch2][C][=C][C][Branch1][C][Br][=N][O][Ring1][=Branch1]
|
c17ccc8cc1.n14nnnc15.c16cc(Br)no1.CCCC4.[C@H]256.C3C7.C8(F)F.N23
|
Cc1c(F)cccc1C1(C(=O)NC[C@H](NC(=O)C2=C[C@H]3CC[C@H]2C3)C(C)C)CC1
|
CccF)cccc6CC=O)NC[C@H]NC=O)C=C[C@H]CC[C@H]6C5)))))))))CC)C))))))CC3
|
[C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][C@H1][C][C][C@H1][Ring1][=Branch1][C][Ring1][Branch1][C][Branch1][C][C][C][C][C][Ring2][Ring1][Branch1]
|
C5(=O)C1=C[C@H]2CC[C@H]1C2.Cc1c9cccc1F.C6[C@H]7C(C)C.C189CC1.C48=O.N46.N57
|
CN(C)CC(=O)N(C)C[C@@H]1CN(C(=O)C(C)(C)c2ccccc2F)CCO1
|
CNC)CC=O)NC)C[C@@H]CNC=O)CC)C)cccccc6F)))))))))CCO6
|
[C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][O][Ring2][Ring1][C]
|
[C@@H]17CN4CCO1.c18ccccc1F.C4(=O)C8(C)C.C5C3=O.CN5C.N36C.C67
|
CCc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CCNC(=O)c1ncc(C)cc1O
|
CCcccc[N+]=O)[O-]))cc6C=O)N[C@@H]C)CCNC=O)cnccC)cc6O
|
[C][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][O]
|
c18ccc([N+](=O)[O-])cc17.c16ncc(C)cc1O.[C@H]4(C)CC5.C27=O.C36=O.CC8.N24.N35
|
C[C@H](O)[C@H](C)C(=O)NC1(C)CN(C(=O)Cc2sccc2-c2ccccc2)C1
|
C[C@H]O)[C@H]C)C=O)NCC)CNC=O)Ccsccc5-cccccc6)))))))))))))C4
|
[C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][S][C][=C][C][=Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring1]
|
C[C@H](O)[C@H](C)C3=O.C15(C)CN4C1.c16sccc17.c17ccccc1.C4(=O)C6.N35
|
CCN(C(=O)c1ccc(OCc2ccccn2)cc1)[C@@H](C)CNC(=O)CCSC
|
CCNC=O)ccccOCcccccn6))))))))cc6)))))))[C@@H]C)CNC=O)CCSC
|
[C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][=C][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][S][C]
|
c1%12ccc7cc1.c14ccccn1.C5(=O)CC%11.[C@H]9(C)C%10.N389.C3%12=O.CC8.O67.C64.N5%10.S%11C
|
CC(C)CNC(=O)[C@@H](CCc1cccc(Cl)c1)N(C)[C@@H](C)C(F)(F)F
|
CCC)CNC=O)[C@@H]CCcccccCl)c6))))))))NC)[C@@H]C)CF)F)F
|
[C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=C][C][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][Branch1][C][C][C@@H1][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C2(=O)[C@H]4CC6.c16cccc(Cl)c1.[C@H]5(C)C(F)(F)F.CC(C)C3.N45C.N23
|
O=C(CCC(F)F)NCC[C@H]1CC(F)(F)CN1C(=O)c1ccn(C2CCC2)n1
|
O=CCCCF)F))))NCC[C@H]CCF)F)CN5C=O)cccnCCCC4))))n5
|
[O][=C][Branch1][Branch2][C][C][C][Branch1][C][F][F][N][C][C][C@H1][C][C][Branch1][C][F][Branch1][C][F][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][N][=Ring1][=Branch2]
|
[C@H]17CC(F)(F)CN14.O=C3CCC(F)F.c16ccn8n1.C18CCC1.C5C7.C46=O.N35
|
CO[C@H]1C[C@@H](CCNC(=O)c2c(F)cc(F)cc2F)N(C(=O)C2CC3(CC3)C2)C1
|
CO[C@H]C[C@@H]CCNC=O)ccF)ccF)cc6F)))))))))))NC=O)CCCCC3))C4)))))C5
|
[C][O][C@H1][C][C@@H1][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][Branch1][C][F][C][=C][Ring1][Branch2][F][N][Branch1][P][C][=Branch1][C][=O][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=Branch1][C][Ring2][Ring1][O]
|
c19c(F)cc(F)cc1F.[C@H]16C[C@@H]%10N5C1.C18CC2(CC2)C1.C%10C7.C49=O.C58=O.CO6.N47
|
O=C(NC[C@@H]1CCN1C(=O)C1(CC2CC2)CC1)[C@@H]1CC12CC(F)(F)C2
|
O=CNC[C@@H]CCN4C=O)CCCCC3))))CC3))))))))))[C@@H]CC3CCF)F)C4
|
[O][=C][Branch2][Ring1][#Branch2][N][C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][Ring1][#Branch1][C@@H1][C][C][Ring1][Ring1][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1]
|
[C@@H]16CC12CC(F)(F)C2.[C@@H]18CCN14.C179CC1.O=C36.C47=O.C1%10CC1.N35.C58.C9%10
|
CC12CCC(C(=O)N3CCO[C@@H](Cn4cc(CO)nn4)C3)(CC1)CC2
|
CCCCCC=O)NCCO[C@@H]CnccCO))nn5))))))C6)))))))CC6))CC6
|
[C][C][C][C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch1][=N][C][N][C][=C][Branch1][Ring1][C][O][N][=N][Ring1][#Branch1][C][Ring1][=C][Branch1][=Branch1][C][C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][Branch2]
|
CC12CCC6(CC1)CC2.N15CCO[C@@H]8C1.n17cc9nn1.C56=O.C78.C9O
|
COC[C@@]1(C(=O)NCc2ocnc2C(=O)N[C@@H](C)Cn2cccn2)CCCO1
|
COC[C@@]C=O)NCcocnc5C=O)N[C@@H]C)Cncccn5)))))))))))))))))CCCO5
|
[C][O][C][C@@][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][C][=C][C][=N][Ring1][Branch1][C][C][C][O][Ring2][Ring1][=Branch2]
|
[C@@]19%12CCCO1.c14ocnc1%10.n1%11cccn1.[C@H]8(C)C%11.C39=O.C5%10=O.CO6.C6%12.N37.C74.N58
|
CCCSCCC(=O)N[C@H]1CN(C(=O)c2c[nH]c(-c3ccccc3)c2)C[C@H]1C
|
CCCSCCC=O)N[C@H]CNC=O)cc[nH]c-cccccc6))))))c5))))))C[C@H]5C
|
[C][C][C][S][C][C][C][=Branch1][C][=O][N][C@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][NH1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][O][C][C@H1][Ring2][Ring1][C][C]
|
[C@H]18CN5C[C@H]1C.c19c[nH]c%10c1.c1%10ccccc1.C7CC4=O.CCC6.C59=O.S67.N48
|
Cc1ncc(F)c(N2CCC[C@H](C(=O)Nc3ccccc3C)C2)n1
|
CcnccF)cNCCC[C@H]C=O)Ncccccc6C)))))))))C6))))))n6
|
[C][C][=N][C][=C][Branch1][C][F][C][Branch2][Ring1][=Branch2][N][C][C][C][C@H1][Branch1][#C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][S][=N][Ring2][Ring1][#Branch1]
|
Cc1ncc(F)c5n1.N15CCC[C@H]7C1.c16ccccc1C.C47=O.N46
|
CCCCCCCCN(C)C(=O)[C@@H]1C=C[C@H](NC(=O)[C@@H]2CC(CC)=NO2)C1
|
CCCCCCCCNC)C=O)[C@@H]C=C[C@H]NC=O)[C@@H]CCCC))=NO5)))))))C5
|
[C][C][C][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][=C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C][Branch1][Ring1][C][C][=N][O][Ring1][#Branch1][C][Ring1][#C]
|
CCCCCCCC5.[C@@H]17CC(CC)=NO1.[C@@H]18C=C[C@H]6C1.N35C.C38=O.C47=O.N46
|
C=C1CC(CN[C@@H](c2nnnn2CCC(=O)OCC)[C@H]2CC2(Br)Br)C1
|
C=CCCCN[C@@H]cnnnn5CCC=O)OCC)))))))))))[C@H]CC3Br)Br)))))))C4
|
[C][=C][C][C][Branch2][Ring1][#C][C][N][C@@H1][Branch1][P][C][=N][N][=N][N][Ring1][Branch1][C][C][C][=Branch1][C][=O][O][C][C][C@H1][C][C][Ring1][Ring1][Branch1][C][Br][Br][C][Ring2][Ring1][Branch2]
|
c18nnnn17.C=C1CC9C1.C7CC3=O.[C@H]1%10CC1(Br)Br.[C@H]68%10.C59.N56.O34.C4C
|
CC(C)[C@@H]1[C@@H](NC(=O)CCOC2CCCCC2)CCN1C(=O)COC1CCC1
|
CCC)[C@@H][C@@H]NC=O)CCOCCCCCC6)))))))))))CCN5C=O)COCCCC4
|
[C][C][Branch1][C][C][C@@H1][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][O][C][C][C][C][C][C][Ring1][=Branch1][C][C][N][Ring1][P][C][=Branch1][C][=O][C][O][C][C][C][C][Ring1][Ring2]
|
[C@@H]1%10[C@@H]9CCN14.C17CCCCC1.C3(=O)CC5.C4(=O)C6.C18CCC1.CC%10C.N39.O57.O68
|
CCO[C@H](C(=O)NCCNC(=O)c1ccc(N)cc1C)[C@H]1CCCOC1
|
CCO[C@H]C=O)NCCNC=O)ccccN)cc6C)))))))))))))[C@H]CCCOC6
|
[C][C][O][C@H1][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][C@H1][C][C][C][O][C][Ring1][=Branch1]
|
c18ccc(N)cc1C.[C@H]19CCCOC1.[C@H]59C2=O.C6C7.C38=O.CC4.O45.N26.N37
|
CC#CC1CCN([C@@H](C(=O)NCCCOC)c2ccc3cc(Br)ccc3n2)CC1
|
CC#CCCCN[C@@H]C=O)NCCCOC)))))))ccccccBr)ccc6n%10)))))))))))CC6
|
[C][C][#C][C][C][C][N][Branch2][Ring1][#C][C@@H1][Branch1][O][C][=Branch1][C][=O][N][C][C][C][O][C][C][=C][C][=C][C][=C][Branch1][C][Br][C][=C][C][Ring1][#Branch1][=N][Ring1][O][C][C][Ring2][Ring1][#Branch2]
|
c18ccc2cc(Br)ccc2n1.CC#CC1CCN6CC1.[C@@H]68C4=O.C7CC5.N47.O5C
|
Cn1cnc(C(=O)N[C@H]2C[C@@H]2CNC(=O)CCC(=O)NC2CCCC2)c1
|
CncncC=O)N[C@H]C[C@@H]3CNC=O)CCC=O)NCCCCC5)))))))))))))))))c5
|
[C][N][C][=N][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][=C][Ring2][Ring1][=Branch2]
|
C4(=O)CCC5=O.Cn1cnc9c1.C18CCCC1.[C@H]17C[C@@H]1%10.C39=O.N37.C6%10.N46.N58
|
O=C([C@H]1CCN(CC(F)(F)F)C1)N1CC[C@H]2[C@@H](C1)CN2C(=O)c1cnc[nH]1
|
O=C[C@H]CCNCCF)F)F)))C5)))))NCC[C@H][C@@H]C6)CN4C=O)ccnc[nH]5
|
[O][=C][Branch2][Ring1][Ring1][C@H1][C][C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][#Branch2][N][C][C][C@H1][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][NH1][Ring1][Branch1]
|
N13CC[C@H]2[C@@H](C1)CN24.[C@H]17CCN5C1.C5C(F)(F)F.c16cnc[nH]1.O=C37.C46=O
|
COC[C@H](OC)C(=O)N1CC2(CO[C@H](CNC(=O)CCn3cccn3)C2)C1
|
COC[C@H]OC))C=O)NCCCO[C@H]CNC=O)CCncccn5))))))))))C5))))C4
|
[C][O][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][O][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C][N][C][=C][C][=N][Ring1][Branch1][C][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14CC2(CO[C@H]%10C2)C1.C6[C@H]7C4=O.C5(=O)CC9.n19cccn1.CO6.O7C.C8%10.N58
|
NC1(CNS(=O)(=O)c2cc(S(N)(=O)=O)ccc2Cl)CCOCC1
|
NCCNS=O)=O)cccSN)=O)=O))ccc6Cl))))))))))CCOCC6
|
[N][C][Branch2][Ring1][=N][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][C][=C][Ring1][#Branch2][Cl][C][C][O][C][C][Ring2][Ring1][=Branch1]
|
S4(=O)(=O)c1cc(S(N)(=O)=O)ccc1Cl.NC15CCOCC1.C35.N34
|
CCCSc1ccc(C(=O)N[C@@H]2COCCN(C(=O)c3cncc(O)c3)C2)cc1
|
CCCSccccC=O)N[C@@H]COCCNC=O)ccnccO)c6)))))))C7)))))))))cc6
|
[C][C][C][S][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][Ring1][S][C][=C][Ring2][Ring1][=Branch2]
|
[C@@H]17COCCN5C1.c1%10ccc8cc1.c19cncc(O)c1.CCC6.C48=O.C59=O.S6%10.N47
|
C[C@H]1[C@@H](NC(=O)c2ccncc2N2CCCC2)CCCN1C(=O)C1=CCCOC1
|
C[C@H][C@@H]NC=O)cccncc6NCCCC5)))))))))))))CCCN6C=O)C=CCCOC6
|
[C][C@H1][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][C][C][C][Ring1][Branch1][C][C][C][N][Ring2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][C][O][C][Ring1][=Branch1]
|
C[C@H]1[C@@H]6CCCN14.C4(=O)C1=CCCOC1.c17ccncc15.N15CCCC1.C37=O.N36
|
CCn1ncnc1C(=O)NC[C@@H]1CN(C(=O)c2coc3c2COC3)C[C@H]1O
|
CCnncnc5C=O)NC[C@@H]CNC=O)ccocc5COC5)))))))))C[C@H]5O
|
[C][C][N][N][=C][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][C][O][C][Ring1][Branch1][C][C@H1][Ring1][#C][O]
|
c18coc2c1COC2.[C@@H]1%10CN5C[C@H]1O.n19ncnc17.C47=O.C58=O.CC9.N46.C6%10
|
CCS(=O)(=O)NCC(=O)N[C@H](C)CCCN=c1[nH]cnc2cc(C3CC3)nn12
|
CCS=O)=O)NCC=O)N[C@H]C)CCCN=c[nH]cncccCCC3)))nn95
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][N][=C][NH1][C][=N][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][N][Ring1][N][Ring1][Branch2]
|
[C@@H]6(C)CCCN=c1[nH]cnc2cc8nn12.CCS7(=O)=O.C5C4=O.C18CC1.N57.N46
|
COc1cccc(-n2nc(COc3ccccc3)nc2-c2cnsc2)c1
|
COccccc-nncCOcccccc6))))))))nc5-ccnsc5))))))))))c6
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][O][N][N][=C][Branch1][O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][=N][C][C][=N][S][C][=Ring1][Branch1][=C][Ring2][Ring1][Branch2]
|
c15cccc8c1.n18nc7nc19.c16ccccc1.c19cnsc1.CO5.C47.O46
|
CCC(CC)(CNC(=O)[C@@H]1CCCN1C=O)NC(=O)c1ccc(Cl)c(C)c1N
|
CCCCC))CNC=O)[C@@H]CCCN5C=O))))))))))NC=O)ccccCl)cC)c6N
|
[C][C][C][Branch1][Ring1][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][C][=C][Ring1][Branch2][N]
|
c17ccc(Cl)c(C)c1N.CCC4(C5)CC.[C@@H]16CCCN1C=O.C26=O.C37=O.N25.N34
|
Cc1cc(C(=O)NC[C@@H](C)[C@]2(O)CCN(C(=O)c3cnc4ccoc4c3)C2)cs1
|
CcccC=O)NC[C@@H]C)[C@]O)CCNC=O)ccncccoc5c9))))))))))C5)))))))))cs5
|
[C][C][=C][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C@][Branch1][C][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][N][=C][C][=C][O][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring1][P][=C][S][Ring2][Ring1][N]
|
c19cnc2ccoc2c1.[C@@]1%10(O)CCN6C1.Cc1cc8cs1.C7[C@H]%10C.C58=O.C69=O.N57
|
CCCc1ccc(C(=O)N2CC[C@@]3(CCCN(C(=O)c4c[nH]c(=N)s4)C3)C2)[nH]1
|
CCCccccC=O)NCC[C@@]CCCNC=O)cc[nH]c=N)s5))))))C6)))))C5))))))[nH]5
|
[C][C][C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][Branch2][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=N][S][Ring1][=Branch1][C][Ring1][=C][C][Ring2][Ring1][C][NH1][Ring2][Ring1][=Branch2]
|
N15CC[C@@]2(CCCN6C2)C1.c19ccc7[nH]1.c18c[nH]c(=N)s1.CCC9.C57=O.C68=O
|
COc1cc(C)nc(N(C(=O)c2ccn(C(C)(C)C)n2)[C@H]2CCCNC2)n1
|
COcccC)ncNC=O)cccnCC)C)C))n5))))))[C@H]CCCNC6)))))))n6
|
[C][O][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring2][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][N][=Ring1][=Branch2][C@H1][C][C][C][N][C][Ring1][=Branch1][=N][Ring2][Ring1][=Branch2]
|
c14cc(C)nc5n1.c17ccn8n1.[C@H]16CCCNC1.C8(C)(C)C.N356.C37=O.CO4
|
O=C1OC[C@@H](C(=O)N[C@@H]2CN(C(=O)c3ccnn3C3CC3)CC[C@H]2CO)O1
|
O=COC[C@@H]C=O)N[C@@H]CNC=O)cccnn5CCC3)))))))))CC[C@H]6CO))))))))))O5
|
[O][=C][O][C][C@@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][Branch1][C][C][C][Ring1][Ring1][C][C][C@H1][Ring1][S][C][O][O][Ring2][Ring1][#Branch2]
|
[C@@H]16CN5CC[C@H]19.O=C1OC[C@@H]7O1.c18ccnn1%10.C47=O.C58=O.C1%10CC1.N46.C9O
|
CCc1ocnc1C(=O)N1CC[C@H](N(CC2CC2)C(=O)[C@H](C)C(C)(C)C)C1
|
CCcocnc5C=O)NCC[C@H]NCCCC3))))C=O)[C@H]C)CC)C)C)))))C5
|
[C][C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][#Branch2][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][C]
|
C4(=O)[C@H](C)C(C)(C)C.c18ocnc17.N13CC[C@H]6C1.C37=O.N456.C19CC1.CC8.C59
|
O=C(NCc1sncc1Br)N1CC[C@@H](OCCN2CCOCC2)C1
|
O=CNCcsncc5Br))))))))NCC[C@@H]OCCNCCOCC6)))))))))C5
|
[O][=C][Branch1][O][N][C][C][S][N][=C][C][=Ring1][Branch1][Br][N][C][C][C@@H1][Branch1][N][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=C]
|
c19sncc1Br.N14CC[C@@H]6C1.N18CCOCC1.O=C34.C5C8.N37.C79.O56
|
C#CC[C@]1(C(=O)NCC[C@@H](C)SC)CCN(C(=O)Cn2ccnn2)C1
|
C#CC[C@]C=O)NCC[C@@H]C)SC)))))))CCNC=O)Cnccnn5)))))))C5
|
[C][#C][C][C@][Branch1][=C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][S][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][C][=C][N][=N][Ring1][Branch1][C][Ring2][Ring1][=Branch1]
|
[C@]179CCN4C1.C5C[C@H]6C.n18ccnn1.C4(=O)C8.C#CC9.C37=O.N35.S6C
|
CCOCC1(C(=O)N2CC(CNC(=O)Cn3cc([N+](=O)[O-])cn3)(COC)C2)CC1
|
CCOCCC=O)NCCCNC=O)Cncc[N+]=O)[O-]))cn5)))))))))COC)))C4)))))CC3
|
[C][C][O][C][C][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=N][Ring1][Branch2][Branch1][Ring2][C][O][C][C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][=Branch2]
|
n1%13cc([N+](=O)[O-])cn1.N14CC56C1.C1%12%14CC1.C7(=O)C%13.C4%12=O.CC8.O89.C9%14.C%115.N7%11.C%106.O%10C
|
CCOc1cc(C(=O)NCCC2(CNC(=O)c3cc(C)cc(F)c3)CC2)ccn1
|
CCOcccC=O)NCCCCNC=O)cccC)ccF)c6)))))))))CC3)))))))ccn6
|
[C][C][O][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][C][Ring1][#C][=C][C][=N][Ring2][Ring1][#Branch2]
|
c1%12cc(C)cc(F)c1.c18cc%11ccn1.C1%135CC1.C4%11=O.C9C%13.C6%12=O.CC7.O78.N49.C%105.N6%10
|
COC1(C(=O)NC[C@]2(C)CN(C(=O)Cc3c(C)nn(C)c3Cl)C[C@H]2C)CC1
|
COCC=O)NC[C@]C)CNC=O)CccC)nnC)c5Cl))))))))C[C@H]5C)))))))))CC3
|
[C][O][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][C][Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][#Branch1][Cl][C][C@H1][Ring1][P][C][C][C][Ring2][Ring1][=Branch2]
|
[C@@]19(C)CN5C[C@H]1C.c1%10c(C)nn(C)c1Cl.C168CC1.C5(=O)C%10.C48=O.CO6.N47.C79
|
COc1ccc(CC(=O)NC[C@@H]2[C@@H](C)CCN2C(=O)c2cc(Cl)n(C)n2)nc1
|
COccccCC=O)NC[C@@H][C@@H]C)CCN5C=O)cccCl)nC)n5)))))))))))))))nc6
|
[C][O][C][=C][C][=C][Branch2][Ring2][Ring1][C][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][Branch1][C][Cl][N][Branch1][C][C][N][=Ring1][#Branch1][N][=C][Ring2][Ring1][#Branch2]
|
c15ccc9nc1.[C@@H]18[C@@H](C)CCN14.c17cc(Cl)n(C)n1.C9C3=O.C47=O.CO5.N36.C68
|
C[C@@]12CC[C@@](CC(=O)NCCCNC(=O)CCN3CCC[C@H](C(N)=O)C3)(CO1)C2
|
C[C@@]CC[C@@]CC=O)NCCCNC=O)CCNCCC[C@H]CN)=O))C6))))))))))))))))CO6))C5
|
[C][C@@][C][C][C@@][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][N][C][=Branch1][C][=O][C][C][N][C][C][C][C@H1][Branch1][=Branch1][C][Branch1][C][N][=O][C][Ring1][=Branch2][Branch1][=Branch1][C][O][Ring2][Ring1][O][C][Ring2][Ring1][N]
|
C[C@@]12CC[C@@]%10(CO1)C2.N18CCC[C@H]9C1.C5(=O)CC8.C%10C4=O.C6CC7.C9(N)=O.N46.N57
|
C[C@@H]1CC(CNC(=O)[C@]2(C)CCCN(C(=O)CN3CCCNC3=O)C2)=NO1
|
C[C@@H]CCCNC=O)[C@]C)CCCNC=O)CNCCCNC6=O)))))))))C6)))))))))=NO5
|
[C][C@@H1][C][C][Branch2][Ring2][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][C][C][N][C][Ring1][=Branch1][=O][C][Ring1][P][=N][O][Ring2][Ring1][#Branch2]
|
[C@@]17(C)CCCN5C1.C[C@@H]1CC(C6)=NO1.N18CCCNC1=O.C5(=O)C8.C47=O.N46
|
CCc1c(C)cccc1C(=O)N1C[C@@H]2CC[C@@]2(CCNC(=O)c2cccn2C)C1
|
CCccC)cccc6C=O)NC[C@@H]CC[C@@]4CCNC=O)ccccn5C))))))))))C7
|
[C][C][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@@][Ring1][Ring2][Branch1][S][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][Ring2][Ring1][C]
|
c19c7cccc1C.N13C[C@@H]2CC[C@@]28C1.c16cccn1C.C37=O.C8C5.C46=O.CC9.N45
|
C#CCO[C@H](C)C(=O)N[C@@]12CCCCC[C@H]1N(c1ccc3nccnc3n1)CC2
|
C#CCO[C@H]C)C=O)N[C@@]CCCCC[C@H]7Nccccnccnc6n%10))))))))))CC%10
|
[C][#C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@][C][C][C][C][C][C@H1][Ring1][#Branch1][N][Branch1][#C][C][=C][C][=C][N][=C][C][=N][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][C][Ring2][Ring1][Ring2]
|
[C@@]128CCCCC[C@H]1N7CC2.c17ccc2nccnc2n1.[C@@H]6(C)C4=O.C#CC5.O56.N48
|
COC1(CC(=O)NC[C@@]23C[C@H]2CN(C(=O)c2ccc(CNS(C)(=O)=O)o2)C3)CC1
|
COCCC=O)NC[C@@]C[C@H]3CNC=O)ccccCNSC)=O)=O))))o5))))))C6))))))))))CC3
|
[C][O][C][Branch2][Ring2][=N][C][C][=Branch1][C][=O][N][C][C@@][C][C@H1][Ring1][Ring1][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][C][N][S][Branch1][C][C][=Branch1][C][=O][=O][O][Ring1][O][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][O]
|
[C@@]125C[C@H]1CN6C2.c1%11ccc%12o1.C17%13CC1.C%13C4=O.S%10(C)(=O)=O.C6%11=O.CO7.N48.C85.C9%12.N9%10
|
O=C1N[C@H](C(=O)N2CCC[C@@]3(NC(=O)c4ccc(F)c5ccsc45)C[C@H]3C2)CO1
|
O=CN[C@H]C=O)NCCC[C@@]NC=O)ccccF)cccsc95)))))))))))C[C@H]3C8)))))))))CO5
|
[O][=C][N][C@H1][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C][C][C@@][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][C][=C][S][C][Ring1][#Branch2][=Ring1][Branch1][C][C@H1][Ring1][S][C][Ring2][Ring1][Branch1][C][O][Ring2][Ring1][N]
|
c1%10ccc(F)c2ccsc12.N16CCC[C@@]28C[C@H]2C1.O=C1N[C@H]9CO1.C69=O.C7%10=O.N78
|
CCC[C@H]1CN(C(=O)CC(C)(C)C(C)=O)C[C@@H]1C(=O)NC(C)(C)[C@H](C)O
|
CCC[C@H]CNC=O)CCC)C)CC)=O)))))C[C@@H]5C=O)NCC)C)[C@H]C)O
|
[C][C][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][=O][C][C@@H1][Ring1][=C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][C][C][O]
|
C2(=O)CC(C)(C)C(C)=O.[C@H]16CN2C[C@@H]15.C4(C)(C)[C@H](C)O.CCC6.C35=O.N34
|
CCOc1ccc(C(=O)N2CCCC[C@H]2C(=O)N[C@@H]2COC(=O)C2)cc1
|
CCOccccC=O)NCCCC[C@H]6C=O)N[C@@H]COC=O)C5))))))))))))))cc6
|
[C][C][O][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1]
|
c16ccc9cc1.N13CCCC[C@H]18.[C@@H]17COC(=O)C1.C39=O.C48=O.CC5.O56.N47
|
CCC1(O)CCN(C(=O)[C@@H]2CN(C(=O)[C@@H](O)CSC)C(C)(C)C2)CC1
|
CCCO)CCNC=O)[C@@H]CNC=O)[C@@H]O)CSC)))))CC)C)C5))))))CC6
|
[C][C][C][Branch1][C][O][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][S][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=C][C][C][Ring2][Ring1][#Branch1]
|
C17(O)CCN3CC1.[C@@H]16CN4C(C)(C)C1.C4(=O)[C@@H](O)C5.C36=O.CC7.S5C
|
CC(C)(C(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)C[C@H]1CCCS1(=O)=O)c1cccs1
|
CCC)C=O)NC[C@@H]CCCC[C@@H]6NC=O)C[C@H]CCCS5=O)=O))))))))))))))))))ccccs5
|
[C][C][Branch1][C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C@H1][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O][C][=C][C][=C][S][Ring1][Branch1]
|
[C@@H]18CCCC[C@@H]15.[C@H]16CCCS1(=O)=O.CC7(C)C2=O.c17cccs1.C3(=O)C6.N24.C48.N35
|
CC1(C)OC(=O)C[C@@H]1C(=O)NCC#CCNC(=O)[C@H](O)c1ccc(F)cc1
|
CCC)OC=O)C[C@@H]5C=O)NCC#CCNC=O)[C@H]O)ccccF)cc6
|
[C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][#C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
CC1(C)OC(=O)C[C@@H]16.c17ccc(F)cc1.C4C#CC5.C3(=O)[C@@H]7O.C26=O.N24.N35
|
O=C(Nc1ccc(NC(=O)c2ccc(Br)nc2F)cn1)c1ccc(CO)o1
|
O=CNccccNC=O)ccccBr)nc6F)))))))))cn6)))))))ccccCO))o5
|
[O][=C][Branch2][Ring1][=C][N][C][=C][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][N][=C][Ring1][#Branch1][F][C][=N][Ring1][P][C][=C][C][=C][Branch1][Ring1][C][O][O][Ring1][#Branch1]
|
c18ccc(Br)nc1F.c15ccc6cn1.c17ccc9o1.O=C37.C48=O.N35.N46.C9O
|
C[C@@H]1CC[S@+]([O-])CCN1C(=O)Nc1ccccc1OC1CCCC1
|
C[C@@H]CC[S@+][O-])CCN7C=O)Ncccccc6OCCCCC5
|
[C][C@@H1][C][C][S@+1][Branch1][C][O-1][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][C][C][Ring1][Branch1]
|
C[C@@H]1CC[S@+]([O-])CCN12.c16ccccc15.C14CCCC1.C23=O.N36.O45
|
C[C@]1(C(=O)Nc2ncc(I)nc2Cl)CCCN1Cc1cnc(Cl)cn1
|
C[C@]C=O)NcnccI)nc6Cl)))))))))CCCN5CccncCl)cn6
|
[C][C@][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][I][N][=C][Ring1][#Branch1][Cl][C][C][C][N][Ring1][S][C][C][=C][N][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1]
|
c15ncc(I)nc1Cl.C[C@]16CCCN14.c17cnc(Cl)cn1.C36=O.N35.C47
|
CC[C@H](OC)C(=O)N1CCC([C@@H]2CCCN2C(=O)c2cnc3occc3c2)CC1
|
CC[C@H]OC))C=O)NCCC[C@@H]CCCN5C=O)ccncoccc5c9)))))))))))))))CC6
|
[C][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch2][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][O][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C][Ring2][Ring1][=Branch1]
|
c17cnc2occc2c1.N14CCC8CC1.CC[C@H]6C4=O.[C@@H]18CCCN15.C57=O.O6C
|
O=C(C[C@@H]1CN2CCC1CC2)N[C@H]1CC[C@H](NC(=O)C(F)(F)CN2CCCC2)C1
|
O=CC[C@@H]CNCCC6CC6)))))))))N[C@H]CC[C@H]NC=O)CF)F)CNCCCC5)))))))))C5
|
[O][=C][Branch1][=C][C][C@@H1][C][N][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1][N][C@H1][C][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][N][C][C][C][C][Ring1][Branch1][C][Ring1][P]
|
[C@@H]18CN2CCC1CC2.C4(=O)C(F)(F)C5.[C@H]16CC[C@H]7C1.N15CCCC1.O=C3C8.N36.N47
|
CCC(CC)(CNC(=O)c1cc(CO)[nH]n1)C(=O)N[C@H](C)C1CCOCC1
|
CCCCC))CNC=O)cccCO))[nH]n5))))))))C=O)N[C@H]C)CCCOCC6
|
[C][C][C][Branch1][Ring1][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][Ring1][C][O][NH1][N][=Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][O][C][C][Ring1][=Branch1]
|
CCC(C4)(CC)C3=O.c16cc7[nH]n1.C18CCOCC1.C26=O.[C@H]58C.N24.C7O.N35
|
COCC1(CNC(=O)Cc2nn(C)cc2Cl)CN(C(=O)[C@@](C)(O)[C@@H]2CCOC2)C1
|
COCCCNC=O)CcnnC)cc5Cl))))))))))CNC=O)[C@@]C)O)[C@@H]CCOC5)))))))C4
|
[C][O][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][Cl][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch1][C][O][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring2][Ring1][#Branch2]
|
c17nn(C)cc1Cl.C189CN4C1.C4(=O)[C@@]%10(C)O.[C@@H]1%10CCOC1.C3(=O)C7.CO5.C58.C69.N36
|
CCC[C@@H](C)C(=O)NC[C@H](NC(=O)CSC1CC1)c1ccc(F)cc1F
|
CCC[C@@H]C)C=O)NC[C@H]NC=O)CSCCC3)))))))ccccF)cc6F
|
[C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][S][C][C][C][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F]
|
c17ccc(F)cc1F.CCC[C@@H](C)C2=O.C4[C@H]57.C3(=O)C6.C18CC1.N24.N35.S68
|
CCC1(C(=O)NCCCN(C)C(=O)C=Cc2ccccc2)CC(C)(C)C1
|
CCCC=O)NCCCNC)C=O)C=Ccccccc6)))))))))))))))CCC)C)C4
|
[C][C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][Branch2]
|
C179CC(C)(C)C1.C=8c1ccccc1.C5CC6.C4(=O)C=8.C37=O.N46C.CC9.N35
|
CC(=O)c1ccc(CC(=O)N[C@]23CCC[C@H]2CN(C(=O)c2cscc2F)C3)cc1
|
CC=O)ccccCC=O)N[C@]CCC[C@H]5CNC=O)ccscc5F)))))))C8)))))))))))cc6
|
[C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C@][C][C][C][C@H1][Ring1][Branch1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][F][C][Ring1][S][C][=C][Ring2][Ring1][#Branch2]
|
[C@]126CCC[C@H]1CN5C2.c17ccc9cc1.c18cscc1F.C9C4=O.CC7=O.C58=O.N46
|
N#Cc1cccc(C(=O)N2CCC(CCNC(=O)c3nnn4c3CCC4)CC2)c1
|
N#CcccccC=O)NCCCCCNC=O)cnnnc5CCC5))))))))))))CC6)))))))c6
|
[N][#C][C][=C][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][N][=N][N][C][=Ring1][Branch1][C][C][C][Ring1][Branch1][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][O]
|
N#Cc1cccc9c1.c18nnn2c1CCC2.N15CCC%10CC1.C59=O.C%10C7.C68=O.N67
|
COC[C@@]1(C(=O)N2CC(C)(NC(=O)c3nnc(Cl)cc3N)C2)CC1(F)F
|
COC[C@@]C=O)NCCC)NC=O)cnncCl)cc6N)))))))))C4)))))CC3F)F
|
[C][O][C][C@@][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=N][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][Ring1][S][C][C][Ring2][Ring1][Branch1][Branch1][C][F][F]
|
c18nnc(Cl)cc1N.[C@@]19%10CC1(F)F.N14CC7(C)C1.C49=O.C58=O.CO6.C6%10.N57
|
O=C(C=CSc1ccccc1)N[C@H]1C[C@@H](NC(=O)Cn2ccc(C(F)(F)F)n2)C1
|
O=CC=CScccccc6)))))))))N[C@H]C[C@@H]NC=O)CncccCF)F)F))n5))))))))C4
|
[O][=C][Branch1][N][C][=C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C@H1][C][C@@H1][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][=Branch2][C][Ring1][P]
|
O=C3C=CS9.c19ccccc1.n17ccc8n1.[C@H]15C[C@@H]6C1.C4(=O)C7.C8(F)(F)F.N35.N46
|
CCC(=O)N(CC)C[C@H](CC)NC(=O)C(=O)Nc1ccc(Cl)cc1
|
CCC=O)NCC))C[C@H]CC))NC=O)C=O)NccccCl)cc6
|
[C][C][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C@H1][Branch1][Ring1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
c18ccc(Cl)cc1.C6[C@@H]7CC.C3(=O)C4=O.CCC2=O.N256.C5C.N37.N48
|
CCC1(NC(=O)C#CC2CCC2)CCN(C(=O)c2sc(C)cc2Br)CC1
|
CCCNC=O)C#CCCCC4))))))))CCNC=O)cscC)cc5Br)))))))CC6
|
[C][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][#C][C][C][C][C][Ring1][Ring2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][S][C][Branch1][C][C][=C][C][=Ring1][=Branch1][Br][C][C][Ring2][Ring1][Branch2]
|
C157CCN4CC1.C3(=O)C#CC1CCC1.c16sc(C)cc1Br.C46=O.CC7.N35
|
C[C@@H](NC(=O)CCSc1ccc(Cl)cc1)[C@@H]1CCCN1C(=O)[C@H](O)CF
|
C[C@@H]NC=O)CCSccccCl)cc6)))))))))))[C@@H]CCCN5C=O)[C@H]O)CF
|
[C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][F]
|
c17ccc(Cl)cc1.[C@@H]16CCCN13.C3(=O)[C@H](O)CF.C2(=O)CC5.C[C@@H]46.N24.S57
|
Cc1ncnc(C)c1CC(=O)NC1CCC(NC(=O)C(=O)N2CC[C@H](C)C2)CC1
|
CcncncC)c6CC=O)NCCCCNC=O)C=O)NCC[C@H]C)C5))))))))CC6
|
[C][C][=N][C][=N][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C][Ring1][=Branch1][C][C][Ring1][P]
|
Cc1ncnc(C)c18.C16CCC7CC1.N15CC[C@H](C)C1.C4(=O)C5=O.C8C3=O.N36.N47
|
Cc1cc(O)ccc1C(=O)N(C)C[C@H](C)CNC(=O)c1ccnc(F)c1
|
CcccO)ccc6C=O)NC)C[C@H]C)CNC=O)cccncF)c6
|
[C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][F][=C][Ring1][#Branch1]
|
Cc1cc(O)ccc16.c17ccnc(F)c1.C4[C@H](C)C5.C26=O.N24C.C37=O.N35
|
O=C(NCCCN1CCSCC1)N1CO[C@H]2CCCC[C@@H]2C1
|
O=CNCCCNCCSCC6))))))))))NCO[C@H]CCCC[C@@H]6C%10
|
[O][=C][Branch1][=N][N][C][C][C][N][C][C][S][C][C][Ring1][=Branch1][N][C][O][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][Ring1][#Branch2]
|
N14CO[C@H]2CCCC[C@@H]2C1.N16CCSCC1.C5CC6.O=C34.N35
|
CCC[C@H](F)C(=O)N[C@@H]1CN(C(=O)c2ccc(C)c(C)c2N)C(C)(C)C1
|
CCC[C@H]F)C=O)N[C@@H]CNC=O)ccccC)cC)c6N))))))))CC)C)C5
|
[C][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2][N][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][C]
|
c16ccc(C)c(C)c1N.[C@@H]15CN4C(C)(C)C1.CCC[C@H](F)C3=O.C46=O.N35
|
C[C@@H](C(=O)NCC[C@H]1CCCN1C(=O)CCC(=O)c1ccc[nH]1)C1CCCC1
|
C[C@@H]C=O)NCC[C@H]CCCN5C=O)CCC=O)cccc[nH]5))))))))))))))))))CCCCC5
|
[C][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][=C][C][=C][NH1][Ring1][Branch1][C][C][C][C][C][Ring1][Branch1]
|
C3(=O)CCC5=O.[C@H]16CCCN13.C[C@H]7C2=O.c15ccc[nH]1.C17CCCC1.C4C6.N24
|
Cc1c(C(=O)N[C@@H]2C[C@H](C)N(C(=O)[C@@H]3CCN(C)C3=O)C2)oc2c1C(=O)CCC2
|
CccC=O)N[C@@H]C[C@H]C)NC=O)[C@@H]CCNC)C5=O)))))))C5)))))))occ5C=O)CCC6
|
[C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C][N][Branch1][C][C][C][Ring1][=Branch1][=O][C][Ring1][#C][O][C][=C][Ring2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][Ring1][#Branch1]
|
Cc1c7oc2c1C(=O)CCC2.[C@@H]16C[C@H](C)N5C1.[C@@H]18CCN(C)C1=O.C47=O.C58=O.N46
|
C=CC[C@H](CC(C)C)C(=O)N1CCN(C(=O)/C=C/C(C)(C)C)C[C@@H]1CC(=O)NC
|
C=CC[C@H]CCC)C)))C=O)NCCNC=O)/C=C/CC)C)C)))))C[C@@H]6CC=O)NC
|
[C][=C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][/C][=C][/C][Branch1][C][C][Branch1][C][C][C][C][C@@H1][Ring1][=C][C][C][=Branch1][C][=O][N][C]
|
C=CC[C@H](CC(C)C)C2=O.N12CCN3C[C@@H]16.C=5C(C)(C)C.C3(=O)C=5.C6C4=O.N4C
|
C[C@]1(C(=O)N2C[C@@H](CO)C3(CCN(C(=O)Cc4cscn4)CC3)C2)COCCO1
|
C[C@]C=O)NC[C@@H]CO))CCCNC=O)Cccscn5)))))))CC6)))))C5))))))COCCO6
|
[C][C@][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][Branch2][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][C][=N][Ring1][Branch1][C][C][Ring1][=C][C][Ring2][Ring1][Ring2][C][O][C][C][O][Ring2][Ring1][N]
|
N15C[C@@H]9C2(CCN6CC2)C1.C[C@]17COCCO1.c18cscn1.C6(=O)C8.C57=O.C9O
|
Cc1nscc1CC(=O)N1C[C@@H]2C[C@H]1[C@@H]2NC(=O)c1sc2ccsc2c1C
|
Ccnscc5CC=O)NC[C@@H]C[C@H]5[C@@H]4NC=O)cscccsc5c8C
|
[C][C][=N][S][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Ring1][Branch1][C@@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C][S][C][C][=C][S][C][=Ring1][Branch1][C][=Ring1][Branch2][C]
|
c16sc2ccsc2c1C.N13C[C@@H]2C[C@H]1[C@@H]25.Cc1nscc17.C7C3=O.C46=O.N45
|
CCO[C@H](CC(=O)N1CC[C@H](NC(=O)Cn2ccc(C)cc2=O)C1(C)C)C(C)C
|
CCO[C@H]CC=O)NCC[C@H]NC=O)CncccC)cc6=O))))))))))C5C)C))))))))CC)C
|
[C][C][O][C@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][N][C][=C][C][Branch1][C][C][=C][C][Ring1][#Branch1][=O][C][Ring1][P][Branch1][C][C][C][C][Branch1][C][C][C]
|
[C@@H]6(CC3=O)C(C)C.N13CC[C@H]7C1(C)C.n18ccc(C)cc1=O.C4(=O)C8.CC5.O56.N47
|
CCCCCCOCC(=O)N1CCCC[C@@H]1CN(C)C(=O)Cc1coc(C)n1
|
CCCCCCOCC=O)NCCCC[C@@H]6CNC)C=O)CccocC)n5
|
[C][C][C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][O][C][Branch1][C][C][=N][Ring1][=Branch1]
|
N12CCCC[C@@H]17.CCCCCC4.c18coc(C)n1.C5C2=O.C3(=O)C8.N36C.O45.C67
|
O=C(N[C@@H]1CC[C@@H](NC(=O)[C@@H]2CCC(F)(F)C2)C1)c1c(O)cc(O)cc1O
|
O=CN[C@@H]CC[C@@H]NC=O)[C@@H]CCCF)F)C5)))))))C5))))))ccO)ccO)cc6O
|
[O][=C][Branch2][Ring1][=C][N][C@@H1][C][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][Ring1][#C][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][O]
|
c18c(O)cc(O)cc1O.[C@@H]17CCC(F)(F)C1.[C@@H]15CC[C@@H]6C1.O=C38.C47=O.N35.N46
|
COc1ccc(CC(=O)NC[C@H]2CN(C(=O)[C@@H]3[C@H](C)[C@@H]3C)CCO2)c(OC)c1
|
COccccCC=O)NC[C@H]CNC=O)[C@@H][C@H]C)[C@@H]3C)))))CCO6))))))))))cOC))c6
|
[C][O][C][=C][C][=C][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][C@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][C][C][C@@H1][Ring1][Ring2][C][C][C][O][Ring1][=N][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][#Branch2]
|
c16ccc%11c7c1.[C@H]1%10CN5CCO1.[C@H]19[C@@H](C)[C@H]1C.C%11C4=O.C59=O.CO6.N48.C8%10.O7C
|
C=CCC1(NC(=O)Cc2cc(C)cc(C)c2)CCN(C(=O)[C@H]2CC23CCC3)CC1
|
C=CCCNC=O)CcccC)ccC)c6)))))))))CCNC=O)[C@H]CC3CCC4)))))))CC6
|
[C][=C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][C][Ring1][Ring2][C][C][Ring2][Ring1][#Branch2]
|
C168CCN5CC1.c19cc(C)cc(C)c1.[C@H]17CC12CCC2.C4(=O)C9.C=CC8.C57=O.N46
|
C[C@H]1CC[C@H](C(=O)NC(C)(C)CN(C)C(=O)C2CC[S+]([O-])CC2)O1
|
C[C@H]CC[C@H]C=O)NCC)C)CNC)C=O)CCC[S+][O-])CC6))))))))))))O5
|
[C][C@H1][C][C][C@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][S+1][Branch1][C][O-1][C][C][Ring1][#Branch1][O][Ring2][Ring1][#Branch1]
|
C18CC[S+]([O-])CC1.C[C@H]1CC[C@H]7O1.C5(C)(C)C6.C37=O.N46C.C48=O.N35
|
Cc1cc(=O)n(C)nc1C(=O)N(C)[C@H]1CCCN(C(=O)[C@H](C)CS(C)(=O)=O)CC1
|
Cccc=O)nC)nc6C=O)NC)[C@H]CCCNC=O)[C@H]C)CSC)=O)=O)))))CC7
|
[C][C][=C][C][=Branch1][C][=O][N][Branch1][C][C][N][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][S]
|
Cc1cc(=O)n(C)nc15.C3(=O)[C@H](C)CS(C)(=O)=O.[C@H]14CCCN3CC1.C25=O.N24C
|
CO[C@@H]1C[C@@H](CNC(=O)CC2(n3cnnn3)CCOCC2)N(C(=O)C2CCC2)C1
|
CO[C@@H]C[C@@H]CNC=O)CCncnnn5)))))CCOCC6))))))))))NC=O)CCCC4)))))C5
|
[C][O][C@@H1][C][C@@H1][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][C][O][C][C][Ring1][O][N][Branch1][O][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][Ring2][Ring1][O]
|
[C@@H]16C[C@@H]9N5C1.C1%10%11CCOCC1.n1%11cnnn1.C4(=O)C%10.C18CCC1.C58=O.CO6.C79.N47
|
CC(C)S(=O)(=O)CC(=O)N1C[C@@H](NC(=O)C=Cc2ccccc2C#N)CC[C@H]1C
|
CCC)S=O)=O)CC=O)NC[C@@H]NC=O)C=Ccccccc6C#N))))))))))))CC[C@H]6C
|
[C][C][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][#N][C][C][C@H1][Ring2][Ring1][Ring1][C]
|
CC(C)S(=O)(=O)CC3=O.C=6c1ccccc1C#N.N13C[C@@H]5CC[C@H]1C.C4(=O)C=6.N45
|
Cc1c(Cl)c[nH]c(=NC[C@@H]2CN(C(=O)c3cnc(Cl)cc3Cl)CC[C@H]2C)c1C#N
|
CccCl)c[nH]c=NC[C@@H]CNC=O)ccncCl)cc6Cl))))))))CC[C@H]6C)))))))))c6C#N
|
[C][C][C][Branch1][C][Cl][=C][NH1][C][=Branch2][Ring1][=C][=N][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][C][C@H1][Ring1][S][C][C][=Ring2][Ring1][#Branch2][C][#N]
|
Cc1c(Cl)c[nH]c(=NC6)c1C#N.[C@@H]16CN4CC[C@H]1C.c15cnc(Cl)cc1Cl.C45=O
|
Cc1nn(C)c(Cl)c1C(=O)N1CC2(NC(=O)CC3CCC(C)CC3)CCC1CC2
|
CcnnC)cCl)c5C=O)NCCNC=O)CCCCCC)CC6)))))))))CCC6CC6
|
[C][C][=N][N][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1][C][C][C][Ring1][P][C][C][Ring1][P]
|
N14CC26CCC1CC2.Cc1nn(C)c(Cl)c17.C18CCC(C)CC1.C5(=O)C8.C47=O.N56
|
CCCCN(C)C[C@@H](C)NC(=O)C(=O)Nc1ccc2ccoc2c1
|
CCCCNC)C[C@@H]C)NC=O)C=O)Nccccccoc5c9
|
[C][C][C][C][N][Branch1][C][C][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][O][C][Ring1][Branch1][=C][Ring1][=Branch2]
|
c18ccc2ccoc2c1.C3(=O)C4=O.CCCC5.C6[C@H]7C.N56C.N37.N48
|
CCCCCC(=O)NCC(=O)NCC[C@@H]1CCCN(C(=O)c2coc(Br)n2)CC1
|
CCCCCC=O)NCC=O)NCC[C@@H]CCCNC=O)ccocBr)n5))))))CC7
|
[C][C][C][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][Br][=N][Ring1][=Branch1][C][C][Ring1][#C]
|
[C@@H]19CCCN5CC1.CCCCCC3=O.c18coc(Br)n1.C6C4=O.C7C9.C58=O.N36.N47
|
CC[C@@H](C)[C@H](C(=O)NCCC(=O)NCC(C)C)N(C)C(=O)Cc1ccsc1
|
CC[C@@H]C)[C@H]C=O)NCCC=O)NCCC)C)))))))))NC)C=O)Ccccsc5
|
[C][C][C@@H1][Branch1][C][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][S][C][=Ring1][Branch1]
|
CC[C@@H](C)[C@@H]5C2=O.C6CC3=O.c18ccsc1.C7C(C)C.C4(=O)C8.N45C.N26.N37
|
CCC[C@@H](C(=O)N[C@]1(CO)CCN(C(=O)Cc2nc(C)sc2Cl)C1)C(C)C
|
CCC[C@@H]C=O)N[C@]CO))CCNC=O)CcncC)sc5Cl))))))))C5)))))))CC)C
|
[C][C][C][C@@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@][Branch1][Ring1][C][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][Cl][C][Ring1][P][C][Branch1][C][C][C]
|
CCC[C@@H](C3=O)C(C)C.[C@@]157CCN4C1.c16nc(C)sc1Cl.C4(=O)C6.N35.C7O
|
CCc1ccc([C@H]2CN(C(=O)C=CI)CCN2C(=O)Cc2sc(O)nc2O)cc1
|
CCcccc[C@H]CNC=O)C=CI))))CCN6C=O)CcscO)nc5O))))))))))))))cc6
|
[C][C][C][=C][C][=C][Branch2][Ring2][C][C@H1][C][N][Branch1][Branch2][C][=Branch1][C][=O][C][=C][I][C][C][N][Ring1][O][C][=Branch1][C][=O][C][C][S][C][Branch1][C][O][=N][C][=Ring1][=Branch1][O][C][=C][Ring2][Ring1][O]
|
[C@H]17CN3CCN14.c16ccc7cc1.c15sc(O)nc1O.C3(=O)C=CI.C4(=O)C5.CC6
|
Cc1ccnc2sc(C(=O)N3CCC[C@]3(C)CNC(=O)[C@H]3CNC(=O)C3)c(C)c12
|
CcccncscC=O)NCCC[C@]5C)CNC=O)[C@H]CNC=O)C5))))))))))))))cC)c95
|
[C][C][=C][C][=N][C][S][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C@][Ring1][Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][C][Ring1][=Branch1][=C][Branch1][C][C][C][Ring2][Ring1][N][=Ring2][Ring1][Branch2]
|
Cc1ccnc2sc7c(C)c12.N14CCC[C@@]19C.[C@H]18CNC(=O)C1.C47=O.C58=O.C69.N56
|
CCc1c[nH]c(C(=O)N2CCCCC[C@H]2CNC(=O)[C@H]2C[C@@H]2c2ccncc2)c1
|
CCcc[nH]cC=O)NCCCCC[C@H]7CNC=O)[C@H]C[C@@H]3cccncc6))))))))))))))))))))c5
|
[C][C][C][=C][NH1][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][C][C][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][O]
|
N13CCCCC[C@H]18.c19c[nH]c6c1.c1%10ccncc1.[C@H]17C[C@@H]1%10.C36=O.C47=O.CC9.C58.N45
|
CCOCCO[C@@H](C)C(=O)N(CCNC(=O)c1nn(C)cc1N)CC1CC1
|
CCOCCO[C@@H]C)C=O)NCCNC=O)cnnC)cc5N))))))))))CCCC3
|
[C][C][O][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][N][C][C][C][C][Ring1][Ring1]
|
c13nn(C)cc1N.[C@H]9(C)C2=O.C7C8.N2%10%12.C%10C%11.C53=O.C14CC1.CC6.O67.O89.N5%11.C%124
|
O=C(Cc1cccc(C(F)(F)F)n1)NC[C@@H]1COCCN1C(=O)Cc1cccs1
|
O=CCcccccCF)F)F))n6)))))))NC[C@@H]COCCN6C=O)Cccccs5
|
[O][=C][Branch2][Ring1][Ring2][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][N][C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][S][Ring1][Branch1]
|
c16cccc7n1.[C@@H]15COCCN13.c18cccs1.O=C2C6.C7(F)(F)F.C3(=O)C8.N24.C45
|
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