SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
C=CC[C@]1(NC(=O)c2csc(CC)n2)CCCN(C(=O)C[C@](C)(O)C(F)(F)F)C1
|
C=CC[C@]NC=O)ccscCC))n5)))))))CCCNC=O)C[C@]C)O)CF)F)F)))))C6
|
[C][=C][C][C@][Branch1][P][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][Ring1][C][C][=N][Ring1][#Branch1][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C@][Branch1][C][C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][#Branch2]
|
C4(=O)C[C@](C)(O)C(F)(F)F.[C@]158CCCN4C1.c16csc7n1.C=CC8.C36=O.N35.C7C
|
O=C([C@H]1CCCN(Cc2ccccc2CCBr)CC1)N1CCC(Br)CC1
|
O=C[C@H]CCCNCcccccc6CCBr))))))))))CC7)))))))NCCCBr)CC6
|
[O][=C][Branch2][Ring1][Branch2][C@H1][C][C][C][N][Branch1][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Br][C][C][Ring1][P][N][C][C][C][Branch1][C][Br][C][C][Ring1][#Branch1]
|
[C@H]15CCCN4CC1.c16ccccc17.N13CCC(Br)CC1.O=C35.C7CBr.C46
|
O=C(N[C@@H](CO)C(F)(F)F)[C@H]1CC[C@@H](C2CC2)N1C(=O)CC1CCCCC1
|
O=CN[C@@H]CO))CF)F)F))))[C@H]CC[C@@H]CCC3)))N5C=O)CCCCCCC6
|
[O][=C][Branch1][#C][N][C@@H1][Branch1][Ring1][C][O][C][Branch1][C][F][Branch1][C][F][F][C@H1][C][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Ring1][Branch2][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][=Branch1]
|
[C@H]5(CO)C(F)(F)F.[C@H]16CC[C@@H]8N14.C17CCCCC1.C4(=O)C7.O=C36.C18CC1.N35
|
C[C@@H]1CCCC[C@H]1n1nc(-c2nccs2)nc1CCn1cnccc1=O
|
C[C@@H]CCCC[C@H]6nnc-cnccs5)))))nc5CCncnccc6=O
|
[C][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][N][=C][Branch1][Branch2][C][=N][C][=C][S][Ring1][Branch1][N][=C][Ring1][#Branch2][C][C][N][C][=N][C][=C][C][Ring1][=Branch1][=O]
|
C[C@@H]1CCCC[C@H]15.n15nc6nc14.n13cnccc1=O.c16nccs1.C4C3
|
C=CC(C)(C)CCNC(=O)[C@@]1(O)CCC[C@@H](C)CC1
|
C=CCC)C)CCNC=O)[C@@]O)CCC[C@@H]C)CC7
|
[C][=C][C][Branch1][C][C][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][C][C@@H1][Branch1][C][C][C][C][Ring1][=Branch2]
|
[C@]14(O)CCC[C@@H](C)CC1.C=CC(C)(C)CC3.C24=O.N23
|
CCOC(=O)CCCC(=O)NC1(C2CCN(C(=O)CCC3CCCC3)CC2)CC1
|
CCOC=O)CCCC=O)NCCCCNC=O)CCCCCCC5))))))))CC6))))))CC3
|
[C][C][O][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch2][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][#C][C][C][Ring2][Ring1][C]
|
C18(C2CCN6CC2)CC1.C4(=O)CCCC5=O.C6(=O)CC9.C19CCCC1.CC7.O47.N58
|
COC(=O)c1cc(C(=O)N2CCC[C@@H]2C2(NC(=O)COCCCF)CC2)cn1C
|
COC=O)cccC=O)NCCC[C@@H]5CNC=O)COCCCF))))))))CC3)))))))))cn5C
|
[C][O][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][Branch1][N][N][C][=Branch1][C][=O][C][O][C][C][C][F][C][C][Ring1][N][=C][N][Ring2][Ring1][Branch2][C]
|
c19cc%10cn1C.N14CCC[C@@H]1%11.C18%11CC1.C5(=O)C6.C7CCF.C39=O.C4%10=O.CO3.N58.O67
|
Cc1cccnc1C(=O)N1CC[C@H](O)[C@H](C(=O)Nc2ccsc2C(N)=O)C1
|
Cccccnc6C=O)NCC[C@H]O)[C@H]C=O)Ncccsc5CN)=O)))))))))C6
|
[C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][O][C@H1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][S][C][=Ring1][Branch1][C][Branch1][C][N][=O][C][Ring2][Ring1][C]
|
N13CC[C@H](O)[C@H]8C1.Cc1cccnc16.c15ccsc17.C36=O.C48=O.C7(N)=O.N45
|
C=C1CC(CC(=O)N2CCC(CCN(C)C(=O)[C@@H]3[C@H](C=C(C)C)C3(C)C)CC2)C1
|
C=CCCCC=O)NCCCCCNC)C=O)[C@@H][C@H]C=CC)C)))C3C)C))))))))CC6))))))))C4
|
[C][=C][C][C][Branch2][Ring2][=N][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][N][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][#Branch1][C][=C][Branch1][C][C][C][C][Ring1][#Branch1][Branch1][C][C][C][C][C][Ring2][Ring1][Branch1][C][Ring2][Ring1][N]
|
N14CCC%10CC1.[C@@H]17[C@H](C=8)C1(C)C.C=C1CC9C1.C9C4=O.C%10C6.N56C.C57=O.C=8(C)C
|
Cn1ccnc1CNC(=O)C1(CCNC(=O)C2=CCOCC2)CC1
|
Cnccnc5CNC=O)CCCNC=O)C=CCOCC6))))))))))CC3
|
[C][N][C][=C][N][=C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][S][C][C][N][C][=Branch1][C][=O][C][=C][C][O][C][C][Ring1][=Branch1][C][C][Ring1][=C]
|
C4(=O)C1=CCOCC1.Cn1ccnc18.C179CC1.C37=O.C9C6.C58.N35.N46
|
O=C([C@@H]1CC12CC2)N1CC[C@]2(CCN(C[C@H](O)COc3ccccc3)C2)C1
|
O=C[C@@H]CC3CC3)))))NCC[C@]CCNC[C@H]O)COcccccc6))))))))))C5))))C5
|
[O][=C][Branch1][#Branch2][C@@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1][N][C][C][C@][Branch2][Ring1][Branch2][C][C][N][Branch1][S][C][C@H1][Branch1][C][O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][S][C][Ring2][Ring1][Ring2]
|
N14CC[C@]2(CCN7C2)C1.c16ccccc1.[C@@H]18CC12CC2.C7[C@H](O)C5.O=C48.O56
|
Cn1cc(C(=O)NC[C@]2(F)C[C@H](NC(=O)c3cnc(S)n3C)C2)c(C(C)(C)C)n1
|
CnccC=O)NC[C@]F)C[C@H]NC=O)ccncS)n5C))))))))C4)))))))cCC)C)C))n5
|
[C][N][C][=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][=C][N][=C][Branch1][C][S][N][Ring1][=Branch1][C][C][Ring1][#C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=N][Ring2][Ring1][N]
|
Cn1cc9c%10n1.c18cnc(S)n1C.[C@]1%11(F)C[C@@H]7C1.C%10(C)(C)C.C49=O.C58=O.N46.C6%11.N57
|
CCc1nocc1C(=O)N1CC2(CN(C(=O)CS(C)(=O)=O)C[C@H]2CO)C1
|
CCcnocc5C=O)NCCCNC=O)CSC)=O)=O))))C[C@H]5CO))))))C4
|
[C][C][C][=N][O][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][N][Branch1][=C][C][=Branch1][C][=O][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C@H1][Ring1][N][C][O][C][Ring1][P]
|
N13CC2(C1)CN4C[C@H]27.C4(=O)CS(C)(=O)=O.c16nocc15.C35=O.CC6.C7O
|
C[C@@]1(F)CN(C(=O)c2ccc(Br)c(O)n2)CCN(C(=O)[C@H]2[C@@H]3CCC[C@@H]32)C1
|
C[C@@]F)CNC=O)ccccBr)cO)n6)))))))CCNC=O)[C@H][C@@H]CCC[C@@H]56)))))))C7
|
[C][C@@][Branch1][C][F][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][O][=N][Ring1][Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C@@H1][C][C][C][C@@H1][Ring1][Branch1][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
C[C@@]1(F)CN4CCN5C1.c16ccc(Br)c(O)n1.[C@@H]17[C@H]2CCC[C@@H]12.C46=O.C57=O
|
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@](C)(Cc3nn[nH]n3)C2)[C@H]2CC(=O)[C@@H]1C2
|
CCC)C)OC=O)N[C@H]C=O)NCC[C@]C)Ccnn[nH]n5))))))C5))))))[C@H]CC=O)[C@@H]6C5
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][C@][Branch1][C][C][Branch1][=Branch2][C][C][N][=N][NH1][N][=Ring1][Branch1][C][Ring1][N][C@H1][C][C][=Branch1][C][=O][C@@H1][Ring2][Ring1][Branch1][C][Ring1][=Branch1]
|
N15[C@H]8[C@H]2CC(=O)[C@@H]1C2.N16CC[C@@]%10(C)C1.c19nn[nH]n1.CC7(C)C.C45=O.C68=O.O47.C9%10
|
O=C(CCCc1ccccn1)N[C@@H]1CCN(c2nc(Cl)ncc2C2CC2)C[C@@H]1O
|
O=CCCCcccccn6)))))))))N[C@@H]CCNcncCl)ncc6CCC3)))))))))C[C@@H]6O
|
[O][=C][Branch1][N][C][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][N][C@@H1][C][C][N][Branch1][P][C][=N][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][C][C][C][Ring1][Ring1][C][C@@H1][Ring1][S][O]
|
[C@@H]15CCN4C[C@@H]1O.c14nc(Cl)ncc17.O=C3CCC6.c16ccccn1.C17CC1.N35
|
COc1cc(CNC23CCC(NC(=O)c4ccc(Cl)o4)(CC2)C3)c(OC)cc1Br
|
COcccCNCCCCNC=O)ccccCl)o5)))))))CC6))C5)))))))cOC))cc6Br
|
[C][O][C][=C][C][Branch2][Ring1][P][C][N][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][O][Ring1][=Branch1][Branch1][Branch1][C][C][Ring1][#C][C][Ring1][S][=C][Branch1][Ring1][O][C][C][=C][Ring2][Ring1][#Branch2][Br]
|
c16cc%12c7cc1Br.C129CCC%10(CC1)C2.c1%11ccc(Cl)o1.C5%11=O.CO6.C8%12.N89.N5%10.O7C
|
COc1ccc(CCC(=O)NC2(CNC(=O)C3=C(C)CCCC3)CCC2)c(F)c1
|
COccccCCC=O)NCCNC=O)C=CC)CCCC6)))))))))CCC4))))))))cF)c6
|
[C][O][C][=C][C][=C][Branch2][Ring2][C][C][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][C][C][C][Ring1][#Branch1][C][C][C][Ring1][#C][C][Branch1][C][F][=C][Ring2][Ring1][O]
|
C5(=O)C1=C(C)CCCC1.c16ccc%10c(F)c1.C%10CC4=O.C179CCC1.CO6.N47.C89.N58
|
CS(=O)(=O)c1ccccc1CC(=O)N1CCC[C@@]2(CC[C@@H](NC(=O)C(N)=O)C2)C1
|
CS=O)=O)cccccc6CC=O)NCCC[C@@]CC[C@@H]NC=O)CN)=O))))C5))))C6
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch2][Ring1][Ring1][C][C][C@@H1][Branch1][O][N][C][=Branch1][C][=O][C][Branch1][C][N][=O][C][Ring1][O][C][Ring1][S]
|
N13CCC[C@@]2(CC[C@@H]5C2)C1.CS(=O)(=O)c1ccccc16.C4(=O)C(N)=O.C6C3=O.N45
|
CNC(=O)c1ccc(C(=O)N[C@@]2(C#N)CCN(Cc3ncc[nH]3)C2)cc1
|
CNC=O)ccccC=O)N[C@@]C#N))CCNCcncc[nH]5))))))C5)))))))cc6
|
[C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C@@][Branch1][Ring1][C][#N][C][C][N][Branch1][=Branch2][C][C][=N][C][=C][NH1][Ring1][Branch1][C][Ring1][=N][C][=C][Ring2][Ring1][=Branch1]
|
[C@]16(C#N)CCN7C1.c18ccc9cc1.c1%10ncc[nH]1.C48=O.C59=O.CN4.N56.C7%10
|
CN(C(=O)[C@H]1CCCN1C=O)[C@@H]1CCN(C(=O)c2cnnc(C3CC3)c2)C1
|
CNC=O)[C@H]CCCN5C=O))))))))[C@@H]CCNC=O)ccnncCCC3)))c6)))))))C5
|
[C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C][C][C][N][Ring1][Branch1][C][=O][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][N][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][Ring1][=Branch2][C][Ring1][S]
|
[C@H]17CCCN1C=O.c18cnnc9c1.[C@@H]16CCN5C1.CN46.C47=O.C58=O.C19CC1
|
CCSc1cncc(C(=O)N2CCC(CNC(=O)C3=CCC3)(C3CCC3)CC2)n1
|
CCSccnccC=O)NCCCCNC=O)C=CCC4)))))))CCCC4))))CC6)))))))n6
|
[C][C][S][C][=C][N][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch1][=N][C][N][C][=Branch1][C][=O][C][=C][C][C][Ring1][Ring2][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][C][Ring2][Ring1][C][=N][Ring2][Ring1][#Branch2]
|
N14CCC9(C2CCC2)CC1.c1%10cncc8n1.C5(=O)C1=CCC1.C48=O.CC7.S7%10.C69.N56
|
COc1ccc2c(c1)C[C@@H](NC(=O)NCC1(c3ccsc3)CC1)CC2
|
COcccccc6)C[C@@H]NC=O)NCCcccsc5)))))CC3)))))))CC6
|
[C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][C][Ring1][Branch2][C][C][Ring2][Ring1][Ring2]
|
c16ccc2c(c1)C[C@@H]8CC2.c1%10ccsc1.C19%10CC1.C45=O.CO6.N48.N57.C79
|
C=CC[C@@H](CC(C)C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2c1ccc(C#N)c(C)n1
|
C=CC[C@@H]CCC)C)))C=O)NCC[C@H]CC[C@@H]C8)N5ccccC#N))cC)n6
|
[C][=C][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch2][N][Ring1][=Branch1][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][C][C][=N][Ring1][=Branch2]
|
C=CC[C@@H](CC(C)C)C3=O.N13CC[C@H]2CC[C@@H](C1)N24.c14ccc(C#N)c(C)n1
|
CCCC(C)(C)C(=O)NCC(C)(C)[C@@H]1CCCN1C(=O)Cc1cc(C2CC2)no1
|
CCCCC)C)C=O)NCCC)C)[C@@H]CCCN5C=O)CcccCCC3)))no5
|
[C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2]
|
CCCC(C)(C)C3=O.[C@@H]16CCCN14.c17cc8no1.C5C6(C)C.C4(=O)C7.C18CC1.N35
|
O=C(N[C@H]1CC12CCC(NC(=O)C1(CF)CC3(CCC3)C1)CC2)c1csc(Cl)c1
|
O=CN[C@H]CC3CCCNC=O)CCF))CCCCC4)))C4))))))CC6)))))))))ccscCl)c5
|
[O][=C][Branch2][Ring2][Branch2][N][C@H1][C][C][Ring1][Ring1][C][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][=Branch2][C][C][Ring2][Ring1][C][C][=C][S][C][Branch1][C][Cl][=C][Ring1][=Branch1]
|
[C@H]16CC12CCC7CC2.C18%10CC2(CCC2)C1.c19csc(Cl)c1.O=C49.C58=O.N46.N57.C%10F
|
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCCN(C(=O)c2ccc(Cl)c(OC)c2F)C1
|
CC[C@@H]C[C@H]3C=O)NC[C@@H]CCCCNC=O)ccccCl)cOC))c6F))))))))C7
|
[C][C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2][F][C][Ring2][Ring1][Ring1]
|
c18ccc(Cl)c5c1F.[C@@H]1%10CCCCN4C1.[C@@H]19C[C@H]17.C37=O.C48=O.CC9.N36.C6%10.O5C
|
CC1CN(C(=O)C(F)(F)C2(O)CCC2)CCN1C(=O)CC1(C)CC1(Cl)Cl
|
CCCNC=O)CF)F)CO)CCC4))))))CCN6C=O)CCC)CC3Cl)Cl
|
[C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][C][N][Ring1][S][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Ring1][Ring2][Branch1][C][Cl][Cl]
|
CC1CN3CCN14.C3(=O)C5(F)F.C16(C)CC1(Cl)Cl.C15(O)CCC1.C4(=O)C6
|
CCN(CCCNC(=O)COc1cc(C)on1)C(=O)c1cc(CC(C)C)on1
|
CCNCCCNC=O)COcccC)on5))))))))))))C=O)cccCCC)C)))on5
|
[C][C][N][Branch2][Ring1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][O][C][C][=C][Branch1][C][C][O][N][=Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][Branch1][#Branch1][C][C][Branch1][C][C][C][O][N][=Ring1][=Branch2]
|
c15cc(C)on1.c19cc%10on1.C7CC8.C2(=O)C4.C%10C(C)C.N367.C39=O.CC6.N28.O45
|
CN(C)C1CCN(C(=O)[C@@]2(Br)C[C@@H]2C(=O)OC(C)(C)C)CC1
|
CNC)CCCNC=O)[C@@]Br)C[C@@H]3C=O)OCC)C)C))))))))CC6
|
[C][N][Branch1][C][C][C][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C@@][Branch1][C][Br][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][Ring1]
|
C16CCN4CC1.[C@]17(Br)C[C@@H]18.C5(C)(C)C.CN6C.C47=O.C38=O.O35
|
CCN(CC)C(=O)[C@H](C)NC(=O)[C@]12CC[C@H](C[C@@H]1NC(=O)C(F)F)C2
|
CCNCC))C=O)[C@H]C)NC=O)[C@]CC[C@H]C[C@@H]6NC=O)CF)F))))))C5
|
[C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@][C][C][C@H1][Branch1][#C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][C][F][F][C][Ring1][=N]
|
[C@]12%10CC[C@H](C[C@@H]19)C2.C3(=O)[C@@H]8C.C5(=O)C(F)F.N367.C4%10=O.CC6.C7C.N48.N59
|
O=C(CCc1cn[nH]c1)N1CC=C(CC(=O)N2CCCCO2)CC1
|
O=CCCccn[nH]c5)))))))NCC=CCC=O)NCCCCO6))))))))CC6
|
[O][=C][Branch1][#Branch2][C][C][C][C][=N][NH1][C][=Ring1][Branch1][N][C][C][=C][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][C][C][O][Ring1][=Branch1][C][C][Ring1][#C]
|
N13CC=C(CC(=O)N2CCCCO2)CC1.O=C3CC4.c14cn[nH]c1
|
CCN(C(=O)[C@@H](C)c1ccsc1)[C@H]1CCN(C(=O)c2cc(F)c(C#N)c(F)c2)C1
|
CCNC=O)[C@@H]C)cccsc5)))))))[C@H]CCNC=O)cccF)cC#N))cF)c6)))))))C5
|
[C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=C][S][C][=Ring1][Branch1][C@H1][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][Ring1][C][#N][C][Branch1][C][F][=C][Ring1][#Branch2][C][Ring1][P]
|
c17cc(F)c(C#N)c(F)c1.[C@H]16CCN4C1.C3(=O)[C@H]8C.c18ccsc1.N356.C47=O.CC5
|
C#CC[C@@]1(C(=O)NCCSC)CCN(C(=O)[C@@H](O)CC(C)C)C1
|
C#CC[C@@]C=O)NCCSC))))))CCNC=O)[C@@H]O)CCC)C)))))C5
|
[C][#C][C][C@@][Branch1][#Branch2][C][=Branch1][C][=O][N][C][C][S][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][Branch1][C][C][C][C][Ring2][Ring1][Ring2]
|
C3(=O)[C@@H](O)CC(C)C.[C@@]167CCN3C1.C#CC7.C26=O.C4C5.N24.S5C
|
CC1(CNC(=O)[C@H]2CCCCN(C(=O)CCCNC(N)=O)C2)CC2(CC2)C1
|
CCCNC=O)[C@H]CCCCNC=O)CCCNCN)=O)))))))C7))))))))))CCCC3))C4
|
[C][C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][N][C][Branch1][C][N][=O][C][Ring1][S][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][#Branch2]
|
[C@H]18CCCCN4C1.CC19CC2(CC2)C1.C4(=O)CCC7.C38=O.C5(N)=O.C69.N36.N57
|
CC(C)CNC(=O)CN1CCC[C@H](CCNC(=O)CC(C)(C)O)C1
|
CCC)CNC=O)CNCCC[C@H]CCNC=O)CCC)C)O)))))))C6
|
[C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][N][C][C][C][C@H1][Branch1][P][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][S]
|
N15CCC[C@H]7C1.C3(=O)CC(C)(C)O.CC(C)C4.C2(=O)C5.C7C6.N24.N36
|
CCC(=O)N[C@H](C)CCC(=O)N(C)CCCC(C)C
|
CCC=O)N[C@H]C)CCC=O)NC)CCCCC)C
|
[C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][Branch1][C][C][C]
|
[C@@H]3(C)CCC2=O.C4CCC(C)C.CCC1=O.N24C.N13
|
C[C@@H](NC(=O)CON=C1CCCCCC1)C1CN(C(=O)C(C2CC2)C2CC2)C1
|
C[C@@H]NC=O)CON=CCCCCCC7))))))))))))CCNC=O)CCCC3)))CCC3)))))C4
|
[C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][O][N][=C][C][C][C][C][C][C][Ring1][#Branch1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][Ring1][C][Ring1][=N]
|
O5N=C1CCCCCC1.C17CN4C1.C4(=O)C89.C3(=O)C5.C[C@@H]67.C18CC1.C19CC1.N36
|
CC[C@@H]1C[C@H]1C(=O)NCCN(C(=O)COC[C@@H]1CCCO1)C1CCCCCC1
|
CC[C@@H]C[C@H]3C=O)NCCNC=O)COC[C@@H]CCCO5)))))))))CCCCCCC7
|
[C][C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][C@@H1][C][C][C][O][Ring1][Branch1][C][C][C][C][C][C][C][Ring1][#Branch1]
|
C19CCCCCC1.[C@@H]1%11CCCO1.[C@@H]13C[C@H]1%10.C4(=O)C5.C2%10=O.C7C8.N489.CC3.N27.O56.C6%11
|
C[C@@H]1C[C@H](C(=O)NC[C@H](O)CN=c2[nH]c3cc(Cl)ccc3s2)CO1
|
C[C@@H]C[C@H]C=O)NC[C@H]O)CN=c[nH]cccCl)ccc6s9)))))))))))))))CO5
|
[C][C@@H1][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][=C][NH1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][C][O][Ring2][Ring1][#Branch1]
|
C5[C@H](O)CN=c1[nH]c2cc(Cl)ccc2s1.C[C@@H]1C[C@H]6CO1.C46=O.N45
|
C[C@@H](CCNC(=O)C(C)(C)O)N(C)C(=O)c1cccc(-c2cnco2)c1
|
C[C@@H]CCNC=O)CC)C)O))))))NC)C=O)ccccc-ccnco5)))))c6
|
[C][C@@H1][Branch1][S][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][O][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][C][=C][N][=C][O][Ring1][Branch1][=C][Ring1][O]
|
c17cccc8c1.C3(=O)C(C)(C)O.C[C@H]5CC6.c18cnco1.N45C.C47=O.N36
|
CC(C)C1=NO[C@@](C)(C(=O)N2CC(CNC(=O)[C@@H]3CCOC3)C2)C1
|
CCC)C=NO[C@@]C)C=O)NCCCNC=O)[C@@H]CCOC5))))))))C4)))))C5
|
[C][C][Branch1][C][C][C][=N][O][C@@][Branch1][C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][Branch1][=C][C][N][C][=Branch1][C][=O][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring1][=N][C][Ring2][Ring1][Branch1]
|
CC(C)C1=NO[C@]7(C)C1.N14CC9C1.[C@@H]18CCOC1.C47=O.C58=O.C69.N56
|
COc1cccc(CN2CC3(CC3)C[C@@H]2C(=O)N=c2[nH][nH]c(C)c2C)c1[N+](=O)[O-]
|
COcccccCNCCCC3))C[C@@H]5C=O)N=c[nH][nH]cC)c5C))))))))))))))c6[N+]=O)[O-]
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][N][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][=C][NH1][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch2][N+1][=Branch1][C][=O][O-1]
|
c14cccc7c1[N+](=O)[O-].C6(=O)N=c1[nH][nH]c(C)c1C.N15CC2(CC2)C[C@@H]16.CO4.C57
|
CC1(CNC(=O)COCCNC(=O)[C@@H]2C[C@H](O)[C@@H](F)C2)CC(O)C1
|
CCCNC=O)COCCNC=O)[C@@H]C[C@H]O)[C@@H]F)C5))))))))))))))CCO)C4
|
[C][C][Branch2][Ring1][=N][C][N][C][=Branch1][C][=O][C][O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][F][C][Ring1][#Branch1][C][C][Branch1][C][O][C][Ring2][Ring1][#Branch1]
|
[C@@H]19C[C@H](O)[C@@H](F)C1.CC1%10CC(O)C1.C3(=O)C5.C6C8.C49=O.C7%10.N37.O56.N48
|
CCN(CCNC(=O)[C@@]1(C)CCO[C@H](C)C1)C(=O)c1coc2c(F)cc(F)cc12
|
CCNCCNC=O)[C@@]C)CCO[C@H]C)C6))))))))))C=O)ccoccF)ccF)cc96
|
[C][C][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][O][C@H1][Branch1][C][C][C][Ring1][Branch2][C][=Branch1][C][=O][C][=C][O][C][=C][Branch1][C][F][C][=C][Branch1][C][F][C][=C][Ring1][O][Ring1][Branch2]
|
c19coc2c(F)cc(F)cc12.[C@]18(C)CCO[C@H](C)C1.N456.C6C7.C38=O.C49=O.CC5.N37
|
CCC[C@]1(C)CCN1C(=O)C(C)(C)[C@H]1CCN(C(=O)c2cnc(N)cn2)C1
|
CCC[C@]C)CCN4C=O)CC)C)[C@H]CCNC=O)ccncN)cn6)))))))C5
|
[C][C][C][C@][Branch1][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][N][C][=N][Ring1][#Branch1][C][Ring1][=C]
|
c15cnc(N)cn1.[C@@]16(C)CCN13.C3(=O)C7(C)C.[C@H]17CCN4C1.CCC6.C45=O
|
CC(C)(C)/C=C/CC(=O)N[C@@]1(CNC(=O)c2ccc3c(c2)CCCC3)CCOC1
|
CCC)C)/C=C/CC=O)N[C@@]CNC=O)cccccc6)CCCC6))))))))))))CCOC5
|
[C][C][Branch1][C][C][Branch1][C][C][/C][=C][/C][C][=Branch1][C][=O][N][C@@][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][C][Ring1][#Branch1][C][C][O][C][Ring2][Ring1][Ring1]
|
c18ccc2c(c1)CCCC2.[C@]16%10CCOC1.CC(C)(C)C=9.C=9CC4=O.C58=O.N46.C7%10.N57
|
C[C@H](CC(=O)NC[C@H]1CC12CCN(C(=O)[C@H](F)c1ccccc1F)CC2)C(F)F
|
C[C@H]CC=O)NC[C@H]CC3CCNC=O)[C@H]F)cccccc6F)))))))))CC6))))))))))))CF)F
|
[C][C@H1][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C@H1][C][C][Ring1][Ring1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][Ring1][P][C][Branch1][C][F][F]
|
[C@H]16CC12CCN4CC2.C[C@H](CC3=O)C(F)F.c17ccccc1F.C4(=O)[C@@H]7F.N35.C56
|
O=C(O)[C@@H]1[C@H]2C=C[C@H]2CN1C(=O)c1cc2ccc(F)cc2cn1
|
O=CO)[C@@H][C@H]C=C[C@H]4CN7C=O)ccccccF)cc6cn%10
|
[O][=C][Branch1][C][O][C@@H1][C@H1][C][=C][C@H1][Ring1][Ring2][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=N][Ring1][O]
|
c15cc2ccc(F)cc2cn1.[C@@H]14[C@H]2C=C[C@H]2CN13.O=C4O.C35=O
|
C#CC1(NC(=O)[C@@]2(NC(=O)[C@H](C)CN(C)C)CCSC2)CC1
|
C#CCNC=O)[C@@]NC=O)[C@H]C)CNC)C))))))CCSC5)))))))CC3
|
[C][#C][C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C@@][Branch1][S][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][N][Branch1][C][C][C][C][C][S][C][Ring1][=C][C][C][Ring2][Ring1][Ring2]
|
[C@@]168CCSC1.C4(=O)[C@H](C)C7.C#CC15CC1.C38=O.N7(C)C.N35.N46
|
C[C@]1(C(=O)N2C[C@@]3(CNC(=O)CCOC4CCCC4)C[C@H]2CO3)CCCNC1=O
|
C[C@]C=O)NC[C@@]CNC=O)CCOCCCCC5)))))))))))C[C@H]5CO5))))))))CCCNC6=O
|
[C][C@][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@][Branch1][P][C][N][C][=Branch1][C][=O][C][C][O][C][C][C][C][C][Ring1][Branch1][C][C@H1][Ring1][P][C][O][Ring1][P][C][C][C][N][C][Ring2][Ring1][O][=O]
|
C[C@]1%10CCCNC1=O.N15C[C@@]2%11C[C@H]1CO2.C6(=O)CC7.C18CCCC1.C5%10=O.C9%11.N69.O78
|
C=CCn1nnnc1[C@@](CCC)(N[C@H]1CCc2nnnn2CC1)C1CCCC1
|
C=CCnnnnc5[C@@]CCC)))N[C@H]CCcnnnn5CC%10)))))))))))CCCCC5
|
[C][=C][C][N][N][=N][N][=C][Ring1][Branch1][C@@][Branch1][Ring2][C][C][C][Branch1][S][N][C@H1][C][C][C][=N][N][=N][N][Ring1][Branch1][C][C][Ring1][#Branch2][C][C][C][C][C][Ring1][Branch1]
|
[C@H]14CCc2nnnn2CC1.n15nnnc16.[C@]367CCC.C17CCCC1.C=CC5.N34
|
CCn1nncc1C(=O)N1CC[C@H]([C@H](C)NC(=O)[C@H]2Cc3ccccc32)C1
|
CCnnncc5C=O)NCC[C@H][C@H]C)NC=O)[C@H]Ccccccc68)))))))))))C5
|
[C][C][N][N][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][=Branch1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][Branch2][C][Ring2][Ring1][C]
|
C5(=O)[C@H]1Cc2ccccc21.n18nncc17.N14CC[C@H]9C1.C47=O.[C@@H]69C.CC8.N56
|
CC1CC(C)(C(=O)N[C@@H]2C[C@H]3CC[C@H]2N(C(=O)C[C@@H]2CCC(=O)[C@H]2C)C3)C1
|
CCCCC)C=O)N[C@@H]C[C@H]CC[C@H]6NC=O)C[C@@H]CCC=O)[C@H]5C))))))))C6))))))))))C4
|
[C][C][C][C][Branch1][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][C][C@H1][Ring1][=Branch1][N][Branch1][P][C][=Branch1][C][=O][C][C@@H1][C][C][C][=Branch1][C][=O][C@H1][Ring1][=Branch1][C][C][Ring1][S][C][Ring2][Ring1][#Branch2]
|
[C@@H]16C[C@H]2CC[C@H]1N5C2.[C@@H]18CCC(=O)[C@H]1C.CC1CC7(C)C1.C5(=O)C8.C47=O.N46
|
CNC(=O)[C@H]1CCN(C(=O)[C@H]2CC[C@H]2CNC(=O)c2cn(C)cn2)[C@H]1C
|
CNC=O)[C@H]CCNC=O)[C@H]CC[C@H]4CNC=O)ccnC)cn5)))))))))))))[C@H]5C
|
[C][N][C][=Branch1][C][=O][C@H1][C][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C@H1][C][C][C@H1][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][C][=N][Ring1][=Branch1][C@H1][Ring2][Ring1][Branch1][C]
|
[C@H]18CCN4[C@H]1C.c17cn(C)cn1.[C@H]19CC[C@H]1%10.C38=O.C49=O.C57=O.CN3.C6%10.N56
|
COCc1ncc(-c2nc(CC3CCCCC3)nn2CC2CCC2)s1
|
COCcncc-cncCCCCCCC6)))))))nn5CCCCC4))))))))))s5
|
[C][O][C][C][=N][C][=C][Branch2][Ring1][#Branch2][C][=N][C][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][=N][N][Ring1][N][C][C][C][C][C][Ring1][Ring2][S][Ring2][Ring1][=Branch1]
|
c1%10nc7nn15.c16ncc%10s1.C18CCCCC1.C19CCC1.CO4.C46.C78.C59
|
C[C@@H](CNC(=O)C=Cc1ccn(C)c1)CNC(=O)c1ccc2nccn2n1
|
C[C@@H]CNC=O)C=CcccnC)c5))))))))))CNC=O)ccccnccn5n9
|
[C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][C][=C][N][Branch1][C][C][C][=Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=N][C][=C][N][Ring1][Branch1][N][=Ring1][=Branch2]
|
c17ccc2nccn2n1.C=8c1ccn(C)c1.C[C@@H](C5)C6.C3(=O)C=8.C47=O.N35.N46
|
CN1CC[C@@](C)(CNC(=O)[C@@H]2CCOCCN2C(=O)C=Cc2cn(C)cn2)C1
|
CNCC[C@@]C)CNC=O)[C@@H]CCOCCN7C=O)C=CccnC)cn5))))))))))))))))))C5
|
[C][N][C][C][C@@][Branch1][C][C][Branch2][Ring1][S][C][N][C][=Branch1][C][=O][C@@H1][C][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][N][Branch1][C][C][C][=N][Ring1][=Branch1][C][Ring2][Ring1][O]
|
[C@@H]16CCOCCN14.CN1CC[C@]8(C)C1.C=7c1cn(C)cn1.C4(=O)C=7.C36=O.C58.N35
|
COC1(CCNC(=O)[C@]2(F)CCCOC2)CN(C(=O)c2csc([N+](=O)[O-])c2)C1
|
COCCCNC=O)[C@]F)CCCOC6))))))))))CNC=O)ccsc[N+]=O)[O-]))c5))))))C4
|
[C][O][C][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][F][C][C][C][O][C][Ring1][#Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][S][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][Branch2][C][Ring2][Ring1][#Branch2]
|
c18csc([N+](=O)[O-])c1.[C@@]17(F)CCCOC1.C159CN4C1.C9C6.C37=O.C48=O.CO5.N36
|
CN(CCCOCCNC(=O)c1cnccc1N(C)C)C(=O)C(=O)NCC(F)F
|
CNCCCOCCNC=O)ccnccc6NC)C))))))))))))))))C=O)C=O)NCCF)F
|
[C][N][Branch2][Ring1][=Branch2][C][C][C][O][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][Branch1][C][F][F]
|
c13cnccc1%11.C4(=O)C5=O.C8CC6.C%10C(F)F.CN48.C7C9.C23=O.N%11(C)C.O67.N29.N5%10
|
O=C(COCC(F)(F)F)NC1(CO)CCN(C(=O)[C@H](F)CC2CC2)CC1
|
O=CCOCCF)F)F)))))NCCO))CCNC=O)[C@H]F)CCCC3))))))CC6
|
[O][=C][Branch1][N][C][O][C][C][Branch1][C][F][Branch1][C][F][F][N][C][Branch1][Ring1][C][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][C][C][C][Ring1][Ring1][C][C][Ring1][S]
|
C178CCN4CC1.C4(=O)[C@H](F)C9.C6C(F)(F)F.O=C3C5.C19CC1.O56.N37.C8O
|
CCC[C@H](C(=O)N1C[C@@H]2C(CNC(=O)COc3cc(C)ccc3F)[C@H]2C1)C(C)C
|
CCC[C@H]C=O)NC[C@@H]CCNC=O)COcccC)ccc6F))))))))))))[C@H]3C6)))))))CC)C
|
[C][C][C][C@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][F][C@H1][Ring1][P][C][Ring2][Ring1][Ring2][C][Branch1][C][C][C]
|
CCC[C@H](C4=O)C(C)C.c17cc(C)ccc1F.N14C[C@@H]2C9[C@H]2C1.C5(=O)C6.C89.N58.O67
|
CN1CC[C@H](C(=O)N2Cc3[nH]nc(C(=O)N4CC(n5cccn5)C4)c3C2)CC1=O
|
CNCC[C@H]C=O)NCc[nH]ncC=O)NCCncccn5)))))C4)))))c5C8)))))))))CC6=O
|
[C][N][C][C][C@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][NH1][N][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][C][Ring1][=Branch2][C][=Ring1][S][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][O][=O]
|
N16Cc2[nH]nc8c2C1.CN1CC[C@H]9CC1=O.N17CC%10C1.n1%10cccn1.C69=O.C78=O
|
C=CC=CCC(=O)NC[C@@]1(NC(=O)CCCCO)CCCC[C@H]1C
|
C=CC=CCC=O)NC[C@@]NC=O)CCCCO)))))))CCCC[C@H]6C
|
[C][=C][C][=C][C][C][=Branch1][C][=O][N][C][C@@][Branch1][O][N][C][=Branch1][C][=O][C][C][C][C][O][C][C][C][C][C@H1][Ring1][=C][C]
|
[C@@]157CCCC[C@H]1C.C3(=O)CCCCO.C=6CC2=O.C=CC=6.N24.C47.N35
|
O=C(Cc1cnccn1)N[C@H]1CC[C@H]1NC(=O)[C@H]1COc2c(F)cc(F)cc2C1
|
O=CCccnccn6)))))))N[C@H]CC[C@H]4NC=O)[C@H]COccF)ccF)cc6C%10
|
[O][=C][Branch1][#Branch2][C][C][=C][N][=C][C][=N][Ring1][=Branch1][N][C@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][C][O][C][=C][Branch1][C][F][C][=C][Branch1][C][F][C][=C][Ring1][Branch2][C][Ring1][N]
|
[C@H]17COc2c(F)cc(F)cc2C1.c18cnccn1.[C@H]15CC[C@H]16.O=C3C8.C47=O.N35.N46
|
C[C@@H](NC(=O)c1ccco1)C(=O)NC12CCC(CC1)N(C(=O)c1ccc(F)o1)C2
|
C[C@@H]NC=O)cccco5)))))))C=O)NCCCCCC6))NC=O)ccccF)o5))))))C6
|
[C][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][O][Ring1][=Branch1][C][Ring1][S]
|
C127CCC(CC1)N5C2.c19ccc(F)o1.C[C@@H]6C4=O.c18ccco1.C38=O.C59=O.N36.N47
|
CC[C@H](C)[C@H](CO)CNC(=O)[C@H]1CCCN(C(=O)[C@@H]2CC23CCCCC3)[C@H]1C
|
CC[C@H]C)[C@H]CO))CNC=O)[C@H]CCCNC=O)[C@@H]CC3CCCCC6)))))))))[C@H]6C
|
[C][C][C@H1][Branch1][C][C][C@H1][Branch1][Ring1][C][O][C][N][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][C][C][C][Ring1][=Branch1][C@H1][Ring1][S][C]
|
CC[C@H](C)[C@@H](C6)CO.[C@H]17CCCN5[C@H]1C.[C@@H]18CC12CCCCC2.C47=O.C58=O.N46
|
CCn1ccc(CC(=O)N2CCN(C(=O)c3c(CO)noc3C)CC23CCC3)n1
|
CCncccCC=O)NCCNC=O)ccCO))noc5C)))))))CC6CCC4)))))))))))n5
|
[C][C][N][C][=C][C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][O][=N][O][C][=Ring1][#Branch1][C][C][C][Ring1][S][C][C][C][Ring1][Ring2][=N][Ring2][Ring1][O]
|
N14CCN5CC12CCC2.c16c9noc1C.n17ccc8n1.C8C4=O.C56=O.CC7.C9O
|
CCN(C)CCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NC(=O)[C@@H](CO)NC(N)=O)C1
|
CCNC)CCC=O)NC[C@@H]CF)F)F))[C@H]NC=O)[C@@H]CO))NCN)=O))))))C5
|
[C][C][N][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][N][C][Branch1][C][N][=O][C][Ring2][Ring1][Ring1]
|
N12C[C@@H]8[C@H]9C1.C3(=O)[C@H]7CO.C6CC2=O.C9(F)(F)F.N56C.C4(N)=O.CC5.N38.N47
|
CC(C)(C)OC(=O)N[C@@H]1C[C@]12C[C@@H]2C(=O)N1C[C@H]2CC[C@H]1CN2C(=O)C1(C)CC1
|
CCC)C)OC=O)N[C@@H]C[C@]3C[C@@H]3C=O)NC[C@H]CC[C@H]6CN6C=O)CC)CC3
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C@@H1][C][C@][Ring1][Ring1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@H1][C][C][C@H1][Ring1][=Branch1][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][C][C][C][C][Ring1][Ring2]
|
N15C[C@H]2CC[C@H]1CN26.[C@@H]18C[C@]12C[C@@H]29.CC7(C)C.C1%10(C)CC1.C34=O.C59=O.C6%10=O.O37.N48
|
CSC(C)(C)C(=O)N(C)C[C@@H](C)N=c1c(C#N)c[nH]c2ccccc12
|
CSCC)C)C=O)NC)C[C@@H]C)N=ccC#N))c[nH]cccccc%106
|
[C][S][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][C][N][=C][C][Branch1][Ring1][C][#N][=C][NH1][C][=C][C][=C][C][=C][Ring1][N][Ring1][=Branch1]
|
C4[C@@H](C)N=c1c(C#N)c[nH]c2ccccc12.C5(C)(C)C3=O.N34C.CS5
|
CC[C@](C)(CNC(=O)c1cccc(F)c1C1CC1)NC(=O)c1cccnc1OC
|
CC[C@]C)CNC=O)cccccF)c6CCC3))))))))))))NC=O)ccccnc6OC
|
[C][C][C@][Branch1][C][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C]
|
c17cccc(F)c19.c18cccnc14.CC[C@]5(C)C6.C27=O.C19CC1.C38=O.N26.N35.O4C
|
COc1coc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3nn(C)cc3C)C2)cc1=O
|
COccocCNCC[C@H][C@H]CCCN6C=O)cnnC)cc5C)))))))))))C6)))))))cc6=O
|
[C][O][C][=C][O][C][Branch2][Ring2][Ring1][C][N][C][C][C@H1][C@H1][Branch2][Ring1][=Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring1][=C][C][Ring2][Ring1][#Branch2][=O]
|
N16CC[C@H]2[C@H](CCCN24)C1.c15coc8cc1=O.c17nn(C)cc1C.C47=O.CO5.C68
|
C=CC[C@]1(NC(=O)[C@@]23CCC[C@@](C)(C2)OC3)CCCN(C(=O)C(=O)C(C)(C)C)C1
|
C=CC[C@]NC=O)[C@@]CCC[C@@]C)C6)OC7)))))))))CCCNC=O)C=O)CC)C)C))))C6
|
[C][=C][C][C@][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@][C][C][C][C@@][Branch1][C][C][Branch1][Ring2][C][Ring1][#Branch1][O][C][Ring1][=Branch2][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][#Branch2]
|
[C@@]127CCC[C@@](C)(C1)OC2.[C@]168CCCN5C1.C5(=O)C(=O)C(C)(C)C.C=CC8.C47=O.N46
|
CCCC(=CC(=O)N1CC(N(C)C(=O)C2C[C@H]3CC[C@@H](C2)N3C)C1)CCC
|
CCCC=CC=O)NCCNC)C=O)CC[C@H]CC[C@@H]C7)N5C))))))))))C4))))))CCC
|
[C][C][C][C][=Branch2][Ring2][=Branch1][=C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][C][Ring1][P][C][C][C]
|
C17C[C@H]2CC[C@@H](C1)N2C.CCCC=8CCC.N14CC6C1.C=8C4=O.N56C.C57=O
|
Cc1ccc([C@@H]2C[C@H]2C(=O)NCC[C@@H](C)N(C)C(=O)C2CC2)o1
|
Ccccc[C@@H]C[C@H]3C=O)NCC[C@@H]C)NC)C=O)CCC3)))))))))))))o5
|
[C][C][=C][C][=C][Branch2][Ring1][=C][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][O][Ring2][Ring1][=Branch1]
|
Cc1ccc9o1.C5C[C@H]6C.[C@@H]19C[C@H]17.C37=O.N46C.C48=O.C18CC1.N35
|
CS(=O)(=O)CCC(=O)N[C@H]1CN(C(=O)c2cnn3ccccc23)CC[C@@H]1CO
|
CS=O)=O)CCC=O)N[C@H]CNC=O)ccnnccccc96))))))))))CC[C@@H]6CO
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=N][N][C][=C][C][=C][C][=Ring1][=Branch2][Ring1][=Branch1][C][C][C@@H1][Ring1][P][C][O]
|
c17cnn2ccccc12.CS(=O)(=O)CCC4=O.[C@H]16CN5CC[C@@H]18.C57=O.N46.C8O
|
C=CCOc1ccc(C(=O)NCC2(C(N)=O)CN(C(=O)[C@H]3C[C@H](O)C3)C2)cc1
|
C=CCOccccC=O)NCCCN)=O))CNC=O)[C@H]C[C@H]O)C4)))))C4)))))))cc6
|
[C][=C][C][O][C][=C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][C][C@H1][Branch1][C][O][C][Ring1][Branch1][C][Ring1][=C][C][=C][Ring2][Ring1][Branch2]
|
c17ccc%11cc1.C19%12CN5C1.[C@H]1%10C[C@H](O)C1.C=CC6.C4%11=O.C9(N)=O.C5%10=O.O67.N48.C8%12
|
C[C@@H]1CN(Cc2ccc(N(C)c3ccccc3)cc2)C[C@H](C(F)(F)F)O1
|
C[C@@H]CNCccccNC)cccccc6)))))))cc6)))))))C[C@H]CF)F)F))O6
|
[C][C@@H1][C][N][Branch2][Ring1][Branch2][C][C][=C][C][=C][Branch1][=N][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][C@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][O][Ring2][Ring1][=Branch2]
|
C[C@@H]1CN4C[C@H]7O1.c18ccc5cc1.c16ccccc1.C7(F)(F)F.N56C.C48
|
Cc1cc(F)c(-c2c(C)cc(Br)c([N+](=O)[O-])c2Br)c(F)c1
|
CcccF)c-ccC)ccBr)c[N+]=O)[O-]))c6Br)))))))cF)c6
|
[C][C][=C][C][Branch1][C][F][=C][Branch2][Ring1][#Branch1][C][=C][Branch1][C][C][C][=C][Branch1][C][Br][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][O][Br][C][Branch1][C][F][=C][Ring2][Ring1][Ring2]
|
c13c(C)cc(Br)c([N+](=O)[O-])c1Br.Cc1cc(F)c3c(F)c1
|
NS(=O)(=O)c1cc(F)cc(NC(=O)N2CC(C3CCOCC3)C2)c1
|
NS=O)=O)cccF)ccNC=O)NCCCCCOCC6))))))C4))))))c6
|
[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][C][Ring1][#Branch2][=C][Ring2][Ring1][Ring2]
|
NS(=O)(=O)c1cc6cc(F)c1.N15CC(C2CCOCC2)C1.C45=O.N46
|
Cc1nc[nH]c1C(=O)N[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)CC1
|
Ccnc[nH]c5C=O)N[C@H]CC[C@H]NC=O)[C@@H]C[C@H]3cccccC#N))c6)))))))))))CC6
|
[C][C][N][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C][C][Ring2][Ring1][Ring2]
|
c19cccc(C#N)c1.[C@H]15CC[C@H]6CC1.Cc1nc[nH]c17.[C@@H]18C[C@H]19.C37=O.C48=O.N35.N46
|
C[C@H]1CN(c2nc(=N)[nH]c(=NCC3C(C)(C)C3(C)C)[nH]2)C[C@@H](C2CC2)O1
|
C[C@H]CNcnc=N)[nH]c=NCCCC)C)C3C)C))))))[nH]6))))))C[C@@H]CCC3)))O6
|
[C][C@H1][C][N][Branch2][Ring1][S][C][=N][C][=Branch1][C][=N][NH1][C][=Branch2][Ring1][C][=N][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch1][Branch1][C][C][C][NH1][Ring1][S][C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring2][Ring1][=Branch2]
|
c14nc(=N)[nH]c(=NC5)[nH]1.C[C@H]1CN4C[C@@H]6O1.C15C(C)(C)C1(C)C.C16CC1
|
C[C@@H](C(=O)N1CC(CNC(=O)c2cnc(S)n2C2CC2)C1)C1CCC(C)(O)CC1
|
C[C@@H]C=O)NCCCNC=O)ccncS)n5CCC3)))))))))))C4)))))CCCCC)O)CC6
|
[C][C@@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][S][N][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][P][C][C][C][C][Branch1][C][C][Branch1][C][O][C][C][Ring1][Branch2]
|
C17CCC(C)(O)CC1.c16cnc(S)n19.C[C@H]7C3=O.N13CC8C1.C46=O.C19CC1.C58.N45
|
CCCC=C[C@H](O)C(=O)N(CC)[C@@H]1CCN(C(=O)c2cnn[nH]2)C1
|
CCCC=C[C@H]O)C=O)NCC))[C@@H]CCNC=O)ccnn[nH]5))))))C5
|
[C][C][C][C][=C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C@@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=N][NH1][Ring1][Branch1][C][Ring1][N]
|
C=8[C@H](O)C3=O.[C@@H]16CCN4C1.c17cnn[nH]1.CCCC=8.N356.C47=O.C5C
|
CNC(=O)c1cccc(C(=O)NC[C@@H](NC(=O)c2cccc(F)c2)C2CCC2)c1
|
CNC=O)cccccC=O)NC[C@@H]NC=O)cccccF)c6))))))))CCCC4))))))))c6
|
[C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][C][C][Ring1][Ring2][=C][Ring2][Ring1][=Branch2]
|
c18cccc9c1.c1%10cccc(F)c1.C6[C@@H]7%11.C1%11CCC1.C38=O.C49=O.C5%10=O.CN3.N46.N57
|
C#C[C@@H]1CN(C(=O)C[C@@H](O)[C@H](C)CC)CCN1C(=O)c1cc2ccc(C)cc2[nH]1
|
C#C[C@@H]CNC=O)C[C@@H]O)[C@H]C)CC))))))CCN6C=O)ccccccC)cc6[nH]9
|
[C][#C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][C][C][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2]
|
c15cc2ccc(C)cc2[nH]1.C#C[C@@H]1CN3CCN14.C3(=O)C[C@@H](O)[C@H](C)CC.C45=O
|
COC(=O)CCCCC(=O)N1CCC[C@@H]1C1(C(=O)N2CC(O)C2)CC1
|
COC=O)CCCCC=O)NCCC[C@@H]5CC=O)NCCO)C4)))))CC3
|
[C][O][C][=Branch1][C][=O][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][Branch1][=C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][Ring1][Branch1][C][C][Ring1][#Branch2]
|
C3(=O)CCCCC4=O.N14CCC[C@@H]17.N15CC(O)C1.C167CC1.C56=O.CO3
|
O=C1C[C@H]2CCC[C@]2(CNC(=O)C2(Oc3ccccc3)CC2)N1
|
O=CC[C@H]CCC[C@]5CNC=O)COcccccc6)))))))CC3))))))N8
|
[O][=C][C][C@H1][C][C][C][C@][Ring1][Branch1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][#Branch2][N][Ring2][Ring1][=Branch1]
|
O=C1C[C@H]2CCC[C@]29N1.c16ccccc1.C158CC1.C48=O.C79.N47.O56
|
CC(C)COCCC(=O)N(C)CCN1CCN(C(=O)C(=O)N2CC[C@@H](C)C2)CC1
|
CCC)COCCC=O)NC)CCNCCNC=O)C=O)NCC[C@@H]C)C5)))))))CC6
|
[C][C][Branch1][C][C][C][O][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C][Ring1][=Branch1][C][C][Ring1][S]
|
N19CCN4CC1.N15CC[C@@H](C)C1.C7CC3=O.C4(=O)C5=O.CC(C)C6.N38C.C8C9.O67
|
C[C@@H](CNC(=O)[C@H]1C[C@@H](O)C1)[C@]1(O)CCN(C(=O)Cc2ccncc2Cl)C1
|
C[C@@H]CNC=O)[C@H]C[C@@H]O)C4)))))))[C@]O)CCNC=O)Ccccncc6Cl)))))))))C5
|
[C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][O][C][Ring1][Branch1][C@][Branch1][C][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][C][=N][C][=C][Ring1][=Branch1][Cl][C][Ring1][S]
|
[C@@]17(O)CCN4C1.c18ccncc1Cl.[C@H]16C[C@@H](O)C1.C[C@H]7C5.C4(=O)C8.C36=O.N35
|
CC(=O)O[C@H]1C[C@@H]1C(=O)N[C@@H](C)[C@H](C)C(=O)NCc1ccc(O)c(C)c1
|
CC=O)O[C@H]C[C@@H]3C=O)N[C@@H]C)[C@H]C)C=O)NCccccO)cC)c6
|
[C][C][=Branch1][C][=O][O][C@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][Branch2]
|
c19ccc(O)c(C)c1.[C@H]6(C)[C@H](C)C4=O.[C@H]15C[C@@H]18.CC2=O.C38=O.O25.N36.N47.C79
|
N#CCCCn1cc(C(=O)NCCC2CN(C(=O)C3(F)CC=CC3)C2)nn1
|
N#CCCCnccC=O)NCCCCNC=O)CF)CC=CC5))))))C4))))))))nn5
|
[N][#C][C][C][C][N][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][Branch1][C][F][C][C][=C][C][Ring1][=Branch1][C][Ring1][N][N][=N][Ring2][Ring1][=Branch1]
|
n19cc7nn1.C18(F)CC=CC1.N#CCCC9.C1%10CN5C1.C47=O.C6C%10.C58=O.N46
|
Cc1cc(CNC(=NCCS(=O)(=O)CC(F)(F)F)NCc2ccco2)n(C)n1
|
CcccCNC=NCCS=O)=O)CCF)F)F)))))))NCcccco5))))))))))nC)n5
|
[C][C][C][=C][Branch2][Ring2][Ring1][C][N][C][=Branch2][Ring1][Ring2][=N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F][N][C][C][=C][C][=C][O][Ring1][Branch1][N][Branch1][C][C][N][=Ring2][Ring1][O]
|
N3C(=NCCS(=O)(=O)CC(F)(F)F)N4.Cc1cc5n(C)n1.c16ccco1.C35.C46
|
CNC(=O)COCC(=O)N1CC=C[C@]1(COC)C(=O)N[C@@H]1C[C@](C)(OC)C1(C)C
|
CNC=O)COCC=O)NCC=C[C@]5COC)))C=O)N[C@@H]C[C@]C)OC))C4C)C
|
[C][N][C][=Branch1][C][=O][C][O][C][C][=Branch1][C][=O][N][C][C][=C][C@][Ring1][Branch1][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][N][C@@H1][C][C@][Branch1][C][C][Branch1][Ring1][O][C][C][Ring1][#Branch1][Branch1][C][C][C]
|
[C@@H]1%10C[C@@]9(C)C1(C)C.N14CC=C[C@@]1%113.C2(=O)C6.C7C4=O.C5%11=O.CN2.O67.C83.O8C.N5%10.O9C
|
CCOC[C@H](C)C(=O)NC[C@](C)(CNC(=O)[C@@H](F)c1ccc(F)cc1)OC
|
CCOC[C@H]C)C=O)NC[C@]C)CNC=O)[C@@H]F)ccccF)cc6))))))))))OC
|
[C][C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C]
|
c19ccc(F)cc1.C5[C@H](C)C2=O.C7[C@]6(C)C8.C3(=O)[C@H]9F.CC4.O45.N27.N38.O6C
|
O=C(Cc1cn2c(n1)CCCC2)N1CCC[C@@H](N(CCO)C(=O)C(F)F)C1
|
O=CCccncn5)CCCC6)))))))))NCCC[C@@H]NCCO)))C=O)CF)F))))C6
|
[O][=C][Branch1][P][C][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C][C][C][Ring1][#Branch1][N][C][C][C][C@@H1][Branch1][S][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C][Branch1][C][F][F][C][Ring1][#C]
|
c17cn2c(n1)CCCC2.N13CCC[C@@H]6C1.C4(=O)C(F)F.O=C3C7.N456.C5CO
|
O=C(Nc1ccc(Cn2cccn2)cc1)N[C@@H]1CC[C@H]2C[C@]21CO
|
O=CNccccCncccn5))))))cc6)))))))N[C@@H]CC[C@H]C[C@]36CO
|
[O][=C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][C][=C][Ring1][N][N][C@@H1][C][C][C@H1][C][C@][Ring1][Ring1][Ring1][=Branch1][C][O]
|
c15ccc9cc1.[C@@H]16CC[C@H]2C[C@]218.n17cccn1.O=C34.N35.C79.N46.C8O
|
O=C(N[C@@H](Cc1cn[nH]c1)C(=O)NC[C@H](O)CF)c1cncc2[nH]ccc12
|
O=CN[C@@H]Cccn[nH]c5))))))C=O)NC[C@H]O)CF))))))))ccncc[nH]ccc95
|
[O][=C][Branch2][Ring1][=Branch2][N][C@@H1][Branch1][=Branch2][C][C][C][=N][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][F][C][=C][N][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1]
|
c17cncc2[nH]ccc12.[C@H]5(C8)C4=O.c18cn[nH]c1.C6[C@H](O)CF.O=C37.N35.N46
|
CCCc1n[nH]cc1C(=O)N[C@@H](C(=O)N[C@H](C)c1ccsc1)C(C)C
|
CCCcn[nH]cc5C=O)N[C@@H]C=O)N[C@H]C)cccsc5))))))))CC)C
|
[C][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][=C][S][C][=Ring1][Branch1][C][Branch1][C][C][C]
|
[C@H]4(C3=O)C(C)C.c17n[nH]cc16.c18ccsc1.CCC7.C26=O.[C@H]58C.N24.N35
|
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