SMILES
stringlengths 17
123
| Deep SMILES
stringlengths 15
129
| SELFIES
stringlengths 71
378
| SAFE
stringlengths 23
156
|
|---|---|---|---|
C[C@@H](NC(=O)COC1CCC1)[C@H]1CCCN1C(=O)C[C@H](NC(N)=O)c1cccs1
|
C[C@@H]NC=O)COCCCC4))))))))[C@H]CCCN5C=O)C[C@H]NCN)=O)))ccccs5
|
[C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][O][C][C][C][C][Ring1][Ring2][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][=C][C][=C][S][Ring1][Branch1]
|
[C@H]19CCCN13.C3(=O)C[C@H]8%10.c1%10cccs1.C2(=O)C5.C16CCC1.C[C@@H]79.C4(N)=O.N27.O56.N48
|
CCc1nc(CC(=O)NC[C@H](C2CC2)N(C)C(=O)C[C@H]2CCCC(=O)N2)cs1
|
CCcncCC=O)NC[C@H]CCC3)))NC)C=O)C[C@H]CCCC=O)N6))))))))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C][C@H1][C][C][C][C][=Branch1][C][=O][N][Ring1][#Branch1][=C][S][Ring2][Ring1][#Branch2]
|
[C@H]17CCCC(=O)N1.c18nc9cs1.C9C3=O.C5[C@@H]6%10.C4(=O)C7.C1%10CC1.N46C.CC8.N35
|
C[C@]1(NC(=O)C[C@@H]2CSCCO2)CCN(C(=O)CNc2cccnc2)C1
|
C[C@]NC=O)C[C@@H]CSCCO6)))))))))CCNC=O)CNccccnc6)))))))))C5
|
[C][C@][Branch1][#C][N][C][=Branch1][C][=O][C][C@@H1][C][S][C][C][O][Ring1][=Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch2]
|
C[C@]15CCN4C1.[C@@H]18CSCCO1.c17cccnc1.C3(=O)C8.C4(=O)C6.N35.N67
|
C[C@]1(NC(=O)C[C@H]2CSCCO2)CCN(C(=O)CNc2cccnc2)C1
|
C[C@]NC=O)C[C@H]CSCCO6)))))))))CCNC=O)CNccccnc6)))))))))C5
|
[C][C@][Branch1][#C][N][C][=Branch1][C][=O][C][C@H1][C][S][C][C][O][Ring1][=Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch2]
|
C[C@]15CCN4C1.[C@H]18CSCCO1.c17cccnc1.C3(=O)C8.C4(=O)C6.N35.N67
|
O=C(C[C@H]1CSCCO1)N[C@]1(CF)CCN(C(=O)CNc2cccnc2)C1
|
O=CC[C@H]CSCCO6)))))))N[C@]CF))CCNC=O)CNccccnc6)))))))))C5
|
[O][=C][Branch1][#Branch2][C][C@H1][C][S][C][C][O][Ring1][=Branch1][N][C@][Branch1][Ring1][C][F][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][P]
|
[C@@]159CCN4C1.[C@H]18CSCCO1.c17cccnc1.O=C3C8.C4(=O)C6.N35.C9F.N67
|
C[C@@]1(NC(=O)C[C@H]2CSCCO2)CCN(C(=O)CNc2cccnc2)C1
|
C[C@@]NC=O)C[C@H]CSCCO6)))))))))CCNC=O)CNccccnc6)))))))))C5
|
[C][C@@][Branch1][#C][N][C][=Branch1][C][=O][C][C@H1][C][S][C][C][O][Ring1][=Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch2]
|
C[C@@]15CCN4C1.[C@H]18CSCCO1.c17cccnc1.C3(=O)C8.C4(=O)C6.N35.N67
|
CN(C(=O)[C@@H](O)CN1CCCC1)[C@H]1[C@@H]2CN(C(=O)CCc3nc(O)n[nH]3)C[C@@H]21
|
CNC=O)[C@@H]O)CNCCCC5))))))))[C@H][C@@H]CNC=O)CCcncO)n[nH]5))))))))C[C@@H]56
|
[C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][N][C][C][C][C][Ring1][Branch1][C@H1][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C][=N][C][Branch1][C][O][=N][NH1][Ring1][=Branch1][C][C@@H1][Ring1][#C][Ring1][S]
|
[C@@H]17[C@H]2CN5C[C@@H]12.C4(=O)[C@@H](O)C6.c18nc(O)n[nH]1.N16CCCC1.C5(=O)CC8.CN47
|
CCOC(=O)[C@H]1N[C@H]2C[C@@H]1C[C@H]2NC(=O)C[C@@H]1CCNC[C@@H]1C1CC1
|
CCOC=O)[C@H]N[C@H]C[C@@H]5C[C@H]5NC=O)C[C@@H]CCNC[C@@H]6CCC3
|
[C][C][O][C][=Branch1][C][=O][C@H1][N][C@H1][C][C@@H1][Ring1][Branch1][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][C@@H1][C][C][N][C][C@@H1][Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
[C@@H]18CCNC[C@@H]1C1CC1.[C@H]17N[C@H]2C[C@@H]1C[C@H]26.C4(=O)C8.C37=O.CC5.O35.N46
|
CC(C)[C@@H]1CN(C(=O)C[C@@H]2CCCSC2)C[C@H]1C(=O)Nc1cnn(CC2CC2)c1
|
CCC)[C@@H]CNC=O)C[C@@H]CCCSC6))))))))C[C@H]5C=O)NccnnCCCC3))))c5
|
[C][C][Branch1][C][C][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@@H1][C][C][C][S][C][Ring1][=Branch1][C][C@H1][Ring1][=C][C][=Branch1][C][=O][N][C][C][=N][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Ring1][=Branch2]
|
[C@@H]18CN3C[C@H]16.[C@@H]19CCCSC1.c15cnn7c1.C3(=O)C9.CC8C.C46=O.C1%10CC1.N45.C7%10
|
Cc1c(Cl)c([C@@H](C(=O)NC2CCOCC2)N2CC[C@H](C3CCOCC3)C2)nn1C
|
CccCl)c[C@@H]C=O)NCCCOCC6))))))))NCC[C@H]CCCOCC6))))))C5))))))nn5C
|
[C][C][=C][Branch1][C][Cl][C][Branch2][Ring2][C][C@@H1][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][O][C][C][Ring1][=Branch1][N][C][C][C@H1][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][C][Ring1][O][=N][N][Ring2][Ring1][O][C]
|
N15CC[C@H](C2CCOCC2)C1.Cc1c(Cl)c7nn1C.C16CCOCC1.[C@H]57C4=O.N46
|
C[C@@](O)(CNC(=O)C1(C2CC2)CCC1)[C@H]1CCCN(C(=O)CCc2ccco2)C1
|
C[C@@]O)CNC=O)CCCC3)))CCC4)))))))[C@H]CCCNC=O)CCcccco5))))))))C6
|
[C][C@@][Branch1][C][O][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][#Branch1][C@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][#C]
|
C16(C2CC2)CCC1.[C@H]18CCCN4C1.C[C@@]8(O)C5.C4(=O)CC7.c17ccco1.C36=O.N35
|
C[C@@H](CC(=O)N1CCC[C@H](CCNC(=O)C2(C3CC3)CCC2)C1)c1ccco1
|
C[C@@H]CC=O)NCCC[C@H]CCNC=O)CCCC3)))CCC4))))))))C6))))))))cccco5
|
[C][C@@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][C][C][=C][C][=C][O][Ring1][Branch1]
|
N14CCC[C@H]9C1.C17(C2CC2)CCC1.C[C@H]8CC4=O.c18ccco1.C9C6.C57=O.N56
|
CC1(C)C=C(C(=O)N2CCO[C@@H](CCNC(=O)c3occ4c3CCCC4)C2)C1
|
CCC)C=CC=O)NCCO[C@@H]CCNC=O)coccc5CCCC6)))))))))))))C6)))))))C4
|
[C][C][Branch1][C][C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][C][Ring2][Ring1][O]
|
c18occ2c1CCCC2.CC1(C)C=C(C5=O)C1.N15CCO[C@@H]9C1.C9C7.C68=O.N67
|
CN1Cc2ccc(NC(=O)C(=O)NCc3ccn(CC(F)F)n3)cc2C1=O
|
CNCccccNC=O)C=O)NCcccnCCF)F)))n5))))))))))cc6C9=O
|
[C][N][C][C][=C][C][=C][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][=C][N][Branch1][#Branch1][C][C][Branch1][C][F][F][N][=Ring1][=Branch2][C][=C][Ring2][Ring1][=Branch1][C][Ring2][Ring1][=Branch2][=O]
|
CN1Cc2ccc7cc2C1=O.c19ccn8n1.C4(=O)C5=O.C8C(F)F.N47.N56.C69
|
Cn1nnc2cc(C(=O)N[C@@H]3C[C@@H](NCCC[C@@H]4CCOC4)C34CCC4)cnc21
|
CnnncccC=O)N[C@@H]C[C@@H]NCCC[C@@H]CCOC5)))))))))C4CCC4)))))))))cnc69
|
[C][N][N][=N][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Branch1][N][N][C][C][C][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring1][=N][C][C][C][Ring1][Ring2][=C][N][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][N]
|
Cn1nnc2cc9cnc21.[C@@H]17C[C@@H]8C12CCC2.[C@@H]1%10CCOC1.C6CC%10.C59=O.N57.N68
|
CC[C@@H]1CN(C(=O)c2cnns2)CC[C@@H]1NC(=O)CCc1csc(=N)[nH]1
|
CC[C@@H]CNC=O)ccnns5))))))CC[C@@H]6NC=O)CCccsc=N)[nH]5
|
[C][C][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=N][S][Ring1][Branch1][C][C][C@@H1][Ring1][=N][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=Branch1][C][=N][NH1][Ring1][=Branch1]
|
[C@@H]18CN3CC[C@@H]15.c17csc(=N)[nH]1.c16cnns1.C4(=O)CC7.C36=O.CC8.N45
|
C[C@@H]1CN(C(=O)c2cnns2)C[C@@H](C)C1NC(=O)CCc1csc(=N)[nH]1
|
C[C@@H]CNC=O)ccnns5))))))C[C@@H]C)C6NC=O)CCccsc=N)[nH]5
|
[C][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][N][=N][S][Ring1][Branch1][C][C@@H1][Branch1][C][C][C][Ring1][=C][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=Branch1][C][=N][NH1][Ring1][=Branch1]
|
C[C@@H]1CN3C[C@@H](C)C15.c17csc(=N)[nH]1.c16cnns1.C4(=O)CC7.C36=O.N45
|
CC(C)c1nnsc1C(=O)N1CC[C@@H](NC(=O)CCc2csc(=N)[nH]2)[C@H](CO)C1
|
CCC)cnnsc5C=O)NCC[C@@H]NC=O)CCccsc=N)[nH]5)))))))))[C@H]CO))C6
|
[C][C][Branch1][C][C][C][N][=N][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=Branch1][C][=N][NH1][Ring1][=Branch1][C@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][Ring1]
|
N13CC[C@@H]5[C@H]9C1.c17nnsc16.c18csc(=N)[nH]1.C4(=O)CC8.CC7C.C36=O.N45.C9O
|
CCc1nnsc1C(=O)N1CC[C@@H](NC(=O)CCc2csc(=N)[nH]2)C[C@@H]1C
|
CCcnnsc5C=O)NCC[C@@H]NC=O)CCccsc=N)[nH]5)))))))))C[C@@H]6C
|
[C][C][C][N][=N][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=Branch1][C][=N][NH1][Ring1][=Branch1][C][C@@H1][Ring1][P][C]
|
N13CC[C@@H]5C[C@@H]1C.c17nnsc16.c18csc(=N)[nH]1.C4(=O)CC8.C36=O.CC7.N45
|
C[C@@]1(C(=O)N[C@@H]2CN(C(=O)Cc3cnc[nH]3)C3(CCCC3)C2)CCCS1
|
C[C@@]C=O)N[C@@H]CNC=O)Cccnc[nH]5)))))))CCCCC5))))C5)))))))CCCS5
|
[C][C@@][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][N][=C][NH1][Ring1][Branch1][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Ring1][P][C][C][C][S][Ring2][Ring1][=Branch2]
|
[C@@H]16CN5C2(CCCC2)C1.C[C@@]17CCCS1.c18cnc[nH]1.C5(=O)C8.C47=O.N46
|
C[C@H](C(=O)NC1CSC1)C1CCN(C(=O)CSCC(=O)N[C@@H]2CCSC2=O)CC1
|
C[C@H]C=O)NCCSC4))))))CCCNC=O)CSCC=O)N[C@@H]CCSC5=O))))))))))))CC6
|
[C][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][S][C][Ring1][Ring2][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][S][C][C][=Branch1][C][=O][N][C@@H1][C][C][S][C][Ring1][Branch1][=O][C][C][Ring2][Ring1][Ring2]
|
C1%10CCN4CC1.[C@@H]19CCSC1=O.C[C@@H]%10C3=O.C18CSC1.C4(=O)C6.C7C5=O.N38.S67.N59
|
O=C(NCCNC(=O)c1csc2cc(Cl)cnc12)c1cnn(-c2ccncc2)c1
|
O=CNCCNC=O)ccscccCl)cnc96))))))))))))))ccnn-cccncc6))))))c5
|
[O][=C][Branch2][Ring1][=Branch2][N][C][C][N][C][=Branch1][C][=O][C][=C][S][C][=C][C][Branch1][C][Cl][=C][N][=C][Ring1][#Branch2][Ring1][#Branch1][C][C][=N][N][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=Ring1][O]
|
c18csc2cc(Cl)cnc12.c17cnn9c1.c19ccncc1.O=C37.C5C6.C48=O.N35.N46
|
CCOC(=O)[C@H]1CCN(C(=O)C2=COCC2)C12CCS(=O)(=O)CC2
|
CCOC=O)[C@H]CCNC=O)C=COCC5))))))C5CCS=O)=O)CC6
|
[C][C][O][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][O][C][C][Ring1][Branch1][C][Ring1][N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][Branch2]
|
[C@H]16CCN4C12CCS(=O)(=O)CC2.C4(=O)C1=COCC1.C36=O.CC5.O35
|
C[C@@H](OCC1CC1)C(=O)N(C)C[C@H]1CN(C(=O)c2cc3c(s2)CCOC3)CCO1
|
C[C@@H]OCCCC3)))))C=O)NC)C[C@H]CNC=O)ccccs5)CCOC6)))))))))CCO6
|
[C][C@@H1][Branch1][Branch2][O][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][O][C][Ring1][#Branch1][C][C][O][Ring1][P]
|
c19cc2c(s1)CCOC2.[C@H]1%10CN5CCO1.C[C@@H]6C4=O.C1%11CC1.N48C.C59=O.O67.C7%11.C8%10
|
CC1(C)CN(C(=O)c2cc3c(s2)CCOC3)C[C@@H](CNC(=O)COCC2CC2)O1
|
CCC)CNC=O)ccccs5)CCOC6)))))))))C[C@@H]CNC=O)COCCCC3)))))))))O6
|
[C][C][Branch1][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][O][C][Ring1][#Branch1][C][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][O][C][C][C][C][Ring1][Ring1][O][Ring2][Ring1][N]
|
CC1(C)CN4C[C@@H]%10O1.c19cc2c(s1)CCOC2.C5(=O)C6.C49=O.C1%11CC1.C8%10.N58.O67.C7%11
|
COC1(C#N)CC(C(=O)N2C[C@H]3CC[C@@]3(CNC(=O)Cc3cscn3)C2)C1
|
COCC#N))CCC=O)NC[C@H]CC[C@@]4CNC=O)Cccscn5)))))))))C7))))))))C4
|
[C][O][C][Branch1][Ring1][C][#N][C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@][Ring1][Ring2][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][=N][Ring1][Branch1][C][Ring1][P][C][Ring2][Ring1][=Branch2]
|
N14C[C@H]2CC[C@@]2%10C1.C16(C#N)CC8C1.c19cscn1.C5(=O)C9.C48=O.CO6.C7%10.N57
|
O=C(Cc1csc(S)n1)NC[C@]12CC[C@H]1CN(C(=O)[C@H]1C[C@@](F)(CO)C1)C2
|
O=CCccscS)n5))))))NC[C@]CC[C@H]4CNC=O)[C@H]C[C@@]F)CO))C4)))))C7
|
[O][=C][Branch1][N][C][C][=C][S][C][Branch1][C][S][=N][Ring1][=Branch1][N][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C@@][Branch1][C][F][Branch1][Ring1][C][O][C][Ring1][#Branch1][C][Ring1][S]
|
[C@]128CC[C@H]1CN4C2.c17csc(S)n1.[C@H]16C[C@]9(F)C1.O=C3C7.C46=O.N35.C58.C9O
|
Cc1nc(CC(=O)NC[C@]23CC[C@H]2CN(C(=O)C2(C#N)CC(F)(F)C2)C3)cs1
|
CcncCC=O)NC[C@]CC[C@H]4CNC=O)CC#N))CCF)F)C4)))))C7)))))))))))cs5
|
[C][C][=N][C][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][N][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2][C][Ring1][P][=C][S][Ring2][Ring1][O]
|
[C@]129CC[C@H]1CN5C2.C17(C#N)CC(F)(F)C1.Cc1nc8cs1.C8C4=O.C57=O.N46.C69
|
Cc1nc(CC(=O)NC[C@]23CC[C@H]2CN(C(=O)C2CC(CCO)C2)C3)c(C)s1
|
CcncCC=O)NC[C@]CC[C@H]4CNC=O)CCCCCO)))C4)))))C7)))))))))))cC)s5
|
[C][C][=N][C][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][Branch1][Ring2][C][C][O][C][Ring1][#Branch1][C][Ring1][S][=C][Branch1][C][C][S][Ring2][Ring1][O]
|
[C@]129CC[C@H]1CN5C2.Cc1nc8c(C)s1.C17CC%10C1.C8C4=O.C57=O.C%10CO.N46.C69
|
CCCC1(C(=O)N2C[C@@H]3CC[C@]3(CNC(=O)Cc3csc(C)n3)C2)CCC1
|
CCCCC=O)NC[C@@H]CC[C@]4CNC=O)CccscC)n5)))))))))C7))))))))CCC4
|
[C][C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][C][Ring2][Ring1][C][C][C][C][Ring2][Ring1][Branch2]
|
N14C[C@@H]2CC[C@]2%10C1.c18csc(C)n1.C179CCC1.C5(=O)C8.CCC9.C47=O.C6%10.N56
|
CO[C@]1(C(F)F)C[C@H](C(=O)N2C[C@@H]3CC[C@]3(CNC(=O)Cc3cscn3)C2)C1
|
CO[C@]CF)F))C[C@H]C=O)NC[C@@H]CC[C@]4CNC=O)Cccscn5)))))))))C7))))))))C4
|
[C][O][C@][Branch1][=Branch1][C][Branch1][C][F][F][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][=N][Ring1][Branch1][C][Ring1][P][C][Ring2][Ring1][#Branch2]
|
N14C[C@@H]2CC[C@]2%11C1.[C@]16%10C[C@@H]8C1.c19cscn1.C5(=O)C9.C%10(F)F.C48=O.CO6.C7%11.N57
|
COCc1nc(CC(=O)NC[C@]23CC[C@H]2CN(C(=O)[C@H]2C[C@@](C)(O)C2)C3)cs1
|
COCcncCC=O)NC[C@]CC[C@H]4CNC=O)[C@H]C[C@@]C)O)C4)))))C7)))))))))))cs5
|
[C][O][C][C][=N][C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C@@][Branch1][C][C][Branch1][C][O][C][Ring1][=Branch1][C][Ring1][#C][=C][S][Ring2][Ring1][=Branch2]
|
[C@]12%11CC[C@H]1CN5C2.c19nc%10cs1.[C@H]18C[C@@](C)(O)C1.C%10C4=O.C58=O.CO6.C69.N47.C7%11
|
Cc1nc(CC(=O)NC[C@]23CC[C@H]2CN(C(=O)C2(CC(F)F)CCC2)C3)cs1
|
CcncCC=O)NC[C@]CC[C@H]4CNC=O)CCCF)F)))CCC4)))))C7)))))))))))cs5
|
[C][C][=N][C][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][Branch1][C][F][F][C][C][C][Ring1][Branch2][C][Ring1][P][=C][S][Ring2][Ring1][O]
|
[C@]129CC[C@H]1CN5C2.Cc1nc8cs1.C17%10CCC1.C8C4=O.C%10C(F)F.C57=O.N46.C69
|
O=C(Cc1csc(S)n1)NC[C@]12CC[C@H]1CN(C(=O)C1CC(CCO)C1)C2
|
O=CCccscS)n5))))))NC[C@]CC[C@H]4CNC=O)CCCCCO)))C4)))))C7
|
[O][=C][Branch1][N][C][C][=C][S][C][Branch1][C][S][=N][Ring1][=Branch1][N][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][Branch1][Ring2][C][C][O][C][Ring1][#Branch1][C][Ring1][S]
|
[C@]128CC[C@H]1CN4C2.c17csc(S)n1.C16CC9C1.O=C3C7.C46=O.C9CO.N35.C58
|
CCC1(C(=O)N2C[C@@H]3CC[C@]3(CNC(=O)Cc3csc(C)n3)C2)CC(C)(C)C1
|
CCCC=O)NC[C@@H]CC[C@]4CNC=O)CccscC)n5)))))))))C7))))))))CCC)C)C4
|
[C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][C][Ring2][Ring1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][#Branch2]
|
N14C[C@@H]2CC[C@]2%10C1.C179CC(C)(C)C1.c18csc(C)n1.C5(=O)C8.C47=O.CC9.C6%10.N56
|
CO[C@H]1C[C@H](C(=O)N2C[C@@H]3CC[C@]3(CNC(=O)Cc3csc(NC=O)n3)C2)C1
|
CO[C@H]C[C@H]C=O)NC[C@@H]CC[C@]4CNC=O)CccscNC=O)))n5)))))))))C7))))))))C4
|
[C][O][C@H1][C][C@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][Ring2][N][C][=O][=N][Ring1][Branch2][C][Ring2][Ring1][Ring2][C][Ring2][Ring1][#Branch2]
|
N14C[C@@H]2CC[C@]2%11C1.c1%10csc8n1.[C@H]16C[C@H]9C1.C5(=O)C%10.C49=O.N8C=O.CO6.C7%11.N57
|
C=CCC1(C(=O)N2C[C@@H]3CC[C@]3(CNC(=O)Cc3csc(NC=O)n3)C2)CCC1
|
C=CCCC=O)NC[C@@H]CC[C@]4CNC=O)CccscNC=O)))n5)))))))))C7))))))))CCC4
|
[C][=C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][Ring2][N][C][=O][=N][Ring1][Branch2][C][Ring2][Ring1][Ring2][C][C][C][Ring2][Ring1][#Branch2]
|
N14C[C@@H]2CC[C@]2%11C1.c19csc7n1.C18%10CCC1.C5(=O)C9.C=CC%10.C48=O.N7C=O.C6%11.N56
|
CCC1(C(=O)N2C[C@@H]3CC[C@]3(CNC(=O)Cc3csc(S)n3)C2)CC(C)(C)C1
|
CCCC=O)NC[C@@H]CC[C@]4CNC=O)CccscS)n5)))))))))C7))))))))CCC)C)C4
|
[C][C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][C][S][=N][Ring1][=Branch1][C][Ring2][Ring1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][#Branch2]
|
N14C[C@@H]2CC[C@]2%10C1.C179CC(C)(C)C1.c18csc(S)n1.C5(=O)C8.C47=O.CC9.C6%10.N56
|
COC1(C(F)F)CC(C(=O)N2C[C@@H]3CC[C@]3(CNC(=O)Cc3cscn3)C2)C1
|
COCCF)F))CCC=O)NC[C@@H]CC[C@]4CNC=O)Cccscn5)))))))))C7))))))))C4
|
[C][O][C][Branch1][=Branch1][C][Branch1][C][F][F][C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][=N][Ring1][Branch1][C][Ring1][P][C][Ring2][Ring1][#Branch2]
|
N14C[C@@H]2CC[C@]2%11C1.C16%10CC8C1.c19cscn1.C5(=O)C9.C%10(F)F.C48=O.CO6.C7%11.N57
|
O=C(CCCc1ccc(Br)cc1)N[C@@H]1CCC[C@H]1C(=O)N1CCCC(F)(F)CC1
|
O=CCCCccccBr)cc6)))))))))N[C@@H]CCC[C@H]5C=O)NCCCCF)F)CC7
|
[O][=C][Branch1][#C][C][C][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][=Branch2]
|
N13CCCC(F)(F)CC1.c16ccc(Br)cc1.O=C2CCC6.[C@@H]14CCC[C@H]15.C35=O.N24
|
O=C(CCCc1ccc(F)cc1)N[C@@H]1CCC[C@@H]1C(=O)N1CCCCC(F)(F)C1
|
O=CCCCccccF)cc6)))))))))N[C@@H]CCC[C@@H]5C=O)NCCCCCF)F)C7
|
[O][=C][Branch1][#C][C][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch2]
|
N13CCCCC(F)(F)C1.c16ccc(F)cc1.O=C2CCC6.[C@@H]14CCC[C@@H]15.C35=O.N24
|
O=C(CCCc1ccc(Br)cc1)N[C@@H]1CCC[C@@H]1C(=O)N1CCCCC(F)(F)C1
|
O=CCCCccccBr)cc6)))))))))N[C@@H]CCC[C@@H]5C=O)NCCCCCF)F)C7
|
[O][=C][Branch1][#C][C][C][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch2]
|
N13CCCCC(F)(F)C1.c16ccc(Br)cc1.O=C2CCC6.[C@@H]14CCC[C@@H]15.C35=O.N24
|
O=C(N[C@@H]1C[C@@H]1CNC(=O)c1cnc2sccn12)c1nc2ncccn2n1
|
O=CN[C@@H]C[C@@H]3CNC=O)ccncsccn85)))))))))))))))cncncccn6n9
|
[O][=C][Branch2][Ring1][=Branch2][N][C@@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][N][=C][S][C][=C][N][Ring1][Branch2][Ring1][Branch1][C][N][=C][N][=C][C][=C][N][Ring1][=Branch1][N][=Ring1][=Branch2]
|
c17nc2ncccn2n1.c18cnc2sccn12.[C@@H]16C[C@@H]19.O=C37.C48=O.N36.C59.N45
|
COC[C@H](NC(=O)[C@@H]1COC(=O)N1)C(=O)NCCc1ncnn1C
|
COC[C@H]NC=O)[C@@H]COC=O)N5)))))))C=O)NCCcncnn5C
|
[C][O][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
C4[C@H]5C3=O.[C@@H]17COC(=O)N1.c18ncnn1C.C27=O.C6C8.CO4.N25.N36
|
C#CC[C@](C)(NC(=O)[C@@H]1COC(=O)N1)C(=O)NCCc1ncnn1C
|
C#CC[C@]C)NC=O)[C@@H]COC=O)N5)))))))C=O)NCCcncnn5C
|
[C][#C][C][C@][Branch1][C][C][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
C#CC[C@@]4(C)C3=O.[C@@H]16COC(=O)N1.c17ncnn1C.C26=O.C5C7.N24.N35
|
CN(C)C[C@H](NC(=O)[C@H]1COC(=O)N1)C(=O)NCCc1ncnn1C
|
CNC)C[C@H]NC=O)[C@H]COC=O)N5)))))))C=O)NCCcncnn5C
|
[C][N][Branch1][C][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
C4[C@H]5C3=O.[C@H]17COC(=O)N1.c18ncnn1C.CN4C.C27=O.C6C8.N25.N36
|
CC(C)OC[C@H](NC(=O)[C@@H]1COC(=O)N1)C(=O)NCCc1ncnn1C
|
CCC)OC[C@H]NC=O)[C@@H]COC=O)N5)))))))C=O)NCCcncnn5C
|
[C][C][Branch1][C][C][O][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
C5[C@H]6C3=O.[C@@H]18COC(=O)N1.c19ncnn1C.CC4C.C28=O.C7C9.O45.N26.N37
|
COC[C@H](NC(=O)[C@H]1COC(=O)N1)C(=O)NCCc1ncnn1C
|
COC[C@H]NC=O)[C@H]COC=O)N5)))))))C=O)NCCcncnn5C
|
[C][O][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
C4[C@H]5C3=O.[C@H]17COC(=O)N1.c18ncnn1C.C27=O.C6C8.CO4.N25.N36
|
CCOC[C@H](NC(=O)[C@@H]1COC(=O)N1)C(=O)NCCc1ncnn1C
|
CCOC[C@H]NC=O)[C@@H]COC=O)N5)))))))C=O)NCCcncnn5C
|
[C][C][O][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
C5[C@H]6C3=O.[C@@H]18COC(=O)N1.c19ncnn1C.C28=O.C7C9.CC4.O45.N26.N37
|
CCOCC[C@@H](NC(=O)[C@@H]1COC(=O)N1C)C(=O)NCCc1ncnn1C
|
CCOCC[C@@H]NC=O)[C@@H]COC=O)N5C))))))))C=O)NCCcncnn5C
|
[C][C][O][C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
C5C[C@@H]6C3=O.[C@@H]18COC(=O)N1C.c19ncnn1C.C28=O.C7C9.CC4.O45.N26.N37
|
CC#CC[C@@H](NC(=O)[C@H]1COC(=O)N1C)C(=O)NCCc1ncnn1C
|
CC#CC[C@@H]NC=O)[C@H]COC=O)N5C))))))))C=O)NCCcncnn5C
|
[C][C][#C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][=N][C][=N][N][Ring1][Branch1][C]
|
CC#CC[C@@H]4C3=O.[C@H]16COC(=O)N1C.c17ncnn1C.C26=O.C5C7.N24.N35
|
C[C@@](O)(C(=O)NC1CCC2(CC1)CN(C(=O)[C@H]1C[C@@H]1C1CC1)C2)C1CCC1
|
C[C@@]O)C=O)NCCCCCC6))CNC=O)[C@H]C[C@@H]3CCC3)))))))C4)))))))))CCCC4
|
[C][C@@][Branch1][C][O][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][Ring1][Ring1][C][Ring1][=C][C][C][C][C][Ring1][Ring2]
|
C15CCC2(CC1)CN4C2.C[C@@]7(O)C3=O.[C@H]16C[C@@H]1C1CC1.C17CCC1.C46=O.N35
|
CCOC1(CC(=O)NC2CCC3(CC2)CN(C(=O)[C@H]2C[C@@H]2C2CC2)C3)CCC1
|
CCOCCC=O)NCCCCCC6))CNC=O)[C@H]C[C@@H]3CCC3)))))))C4))))))))))CCC4
|
[C][C][O][C][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][C][C][Ring1][Ring1][C][Ring1][=C][C][C][C][Ring2][Ring1][=Branch2]
|
C18CCC2(CC1)CN5C2.[C@H]19C[C@@H]1C1CC1.C17%10CCC1.C%10C4=O.C59=O.CC6.O67.N48
|
CO[C@H]1C[C@@H](CC(=O)NC2CCC3(CC2)CN(C(=O)[C@@H]2[C@@H](C4CC4)C2(F)F)C3)C1
|
CO[C@H]C[C@@H]CC=O)NCCCCCC6))CNC=O)[C@@H][C@@H]CCC3)))C3F)F)))))C4))))))))))C4
|
[C][O][C@H1][C][C@@H1][Branch2][Ring2][=N][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=Branch1][Branch1][C][F][F][C][Ring1][S][C][Ring2][Ring1][O]
|
C18CCC2(CC1)CN6C2.[C@@H]19[C@@H](C2CC2)C1(F)F.[C@H]17C[C@@H]%10C1.C%10C5=O.C69=O.CO7.N58
|
CO[C@H]1C[C@@H](CC(=O)NC2CCC3(CC2)CN(C(=O)[C@@H]2C[C@H]2C2CC2)C3)C1
|
CO[C@H]C[C@@H]CC=O)NCCCCCC6))CNC=O)[C@@H]C[C@H]3CCC3)))))))C4))))))))))C4
|
[C][O][C@H1][C][C@@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C][C][C][Ring1][Ring1][C][Ring1][=C][C][Ring2][Ring1][=Branch2]
|
C17CCC2(CC1)CN5C2.[C@@H]18C[C@H]1C1CC1.[C@H]16C[C@@H]9C1.C9C4=O.C58=O.CO6.N47
|
CCOC1CC(CC(=O)NC2CCC3(CC2)CN(C(=O)[C@@H]2C[C@@H]2[C@@H]2C[C@@H]2C)C3)C1
|
CCOCCCCC=O)NCCCCCC6))CNC=O)[C@@H]C[C@@H]3[C@@H]C[C@@H]3C))))))))C4))))))))))C4
|
[C][C][O][C][C][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C@@H1][C][C@@H1][Ring1][Ring1][C][C][Ring1][#C][C][Ring2][Ring1][#Branch2]
|
C18CCC2(CC1)CN5C2.[C@@H]19C[C@@H]1[C@@H]1C[C@@H]1C.C17CC%10C1.C%10C4=O.C59=O.CC6.O67.N48
|
CCOC1CC(CC(=O)NC2CCC3(CC2)CN(C(=O)[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)C3)C1
|
CCOCCCCC=O)NCCCCCC6))CNC=O)[C@@H]C[C@@H]3[C@@H]C[C@H]3C))))))))C4))))))))))C4
|
[C][C][O][C][C][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C@@H1][C][C@H1][Ring1][Ring1][C][C][Ring1][#C][C][Ring2][Ring1][#Branch2]
|
C18CCC2(CC1)CN5C2.[C@@H]19C[C@@H]1[C@@H]1C[C@H]1C.C17CC%10C1.C%10C4=O.C59=O.CC6.O67.N48
|
C[C@@](O)(C(=O)NC1CCC2(CC1)CN(C(=O)[C@@H]1[C@@H](C3CC3)C1(F)F)C2)C1CCC1
|
C[C@@]O)C=O)NCCCCCC6))CNC=O)[C@@H][C@@H]CCC3)))C3F)F)))))C4)))))))))CCCC4
|
[C][C@@][Branch1][C][O][Branch2][Ring2][N][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=Branch1][Branch1][C][F][F][C][Ring1][S][C][C][C][C][Ring1][Ring2]
|
C16CCC2(CC1)CN5C2.[C@@H]17[C@@H](C2CC2)C1(F)F.C[C@@]8(O)C4=O.C18CCC1.C57=O.N46
|
C=C1CC(C(=O)NCC[C@@H]2CN(C(=O)Cc3ccsc3)CCCO2)C1
|
C=CCCC=O)NCC[C@@H]CNC=O)Ccccsc5)))))))CCCO7)))))))))))C4
|
[C][=C][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][S][C][=Ring1][Branch1][C][C][C][O][Ring1][#C][C][Ring2][Ring1][Branch2]
|
[C@@H]18CN5CCCO1.C=C1CC7C1.c19ccsc1.C5(=O)C9.C47=O.C6C8.N46
|
CCC1(NC(=O)c2cc3ccncc3[nH]2)CN(C(=O)[C@H]2CCO[C@@H]2C2CC2)C1
|
CCCNC=O)cccccncc6[nH]9)))))))))))CNC=O)[C@H]CCO[C@@H]5CCC3)))))))))C4
|
[C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=N][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][C][C][O][C@@H1][Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][#Branch2]
|
c17cc2ccncc2[nH]1.C169CN5C1.[C@H]18CCO[C@@H]1%10.C47=O.C58=O.C1%10CC1.CC9.N46
|
Cc1cc(CC(=O)N2CC=C[C@H](NC(=O)CCCCN3CCCC3)C2)ccc1Cl
|
CcccCC=O)NCC=C[C@H]NC=O)CCCCNCCCC5)))))))))))C6))))))))ccc6Cl
|
[C][C][=C][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][=C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][C][C][N][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][C][=C][C][=C][Ring2][Ring1][O][Cl]
|
Cc1cc8ccc1Cl.N14CC=C[C@H]7C1.C5(=O)CCCC6.N16CCCC1.C8C4=O.N57
|
O=C(CCCCN1CCCC1)N[C@H]1C=CCN(C(=O)Cc2cccc(F)c2F)C1
|
O=CCCCCNCCCC5)))))))))N[C@H]C=CCNC=O)CcccccF)c6F)))))))))C6
|
[O][=C][Branch1][N][C][C][C][C][N][C][C][C][C][Ring1][Branch1][N][C@H1][C][=C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F][C][Ring1][P]
|
c17cccc(F)c1F.O=C3CCCC5.[C@H]16C=CCN4C1.N15CCCC1.C4(=O)C7.N36
|
O=C(CCCCN1CCCC1)N[C@H]1C=CCN(C(=O)Cc2ccc(O)cc2)C1
|
O=CCCCCNCCCC5)))))))))N[C@H]C=CCNC=O)CccccO)cc6))))))))C6
|
[O][=C][Branch1][N][C][C][C][C][N][C][C][C][C][Ring1][Branch1][N][C@H1][C][=C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][Ring1][S]
|
O=C3CCCC5.[C@H]16C=CCN4C1.c17ccc(O)cc1.N15CCCC1.C4(=O)C7.N36
|
Cc1cc(C)cc(CC(=O)N2CC=C[C@H](NC(=O)CCCCN3CCCC3)C2)c1
|
CcccC)ccCC=O)NCC=C[C@H]NC=O)CCCCNCCCC5)))))))))))C6))))))))c6
|
[C][C][=C][C][Branch1][C][C][=C][C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][=C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][C][C][N][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][C][=C][Ring2][Ring1][N]
|
Cc1cc8cc(C)c1.N14CC=C[C@H]7C1.C5(=O)CCCC6.N16CCCC1.C8C4=O.N57
|
Cc1cc(O)ccc1CC(=O)N1CC=C[C@@H](NC(=O)CCCCN2CCCC2)C1
|
CcccO)ccc6CC=O)NCC=C[C@@H]NC=O)CCCCNCCCC5)))))))))))C6
|
[C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][=C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][C][C][N][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][C]
|
Cc1cc(O)ccc17.N13CC=C[C@@H]6C1.C4(=O)CCCC5.N15CCCC1.C7C3=O.N46
|
C[C@H](NC(=O)[C@H]1COCCN1c1ncc2ccsc2n1)c1nccs1
|
C[C@H]NC=O)[C@H]COCCN6cnccccsc5n9)))))))))))))))))cnccs5
|
[C][C@H1][Branch2][Ring1][O][N][C][=Branch1][C][=O][C@H1][C][O][C][C][N][Ring1][=Branch1][C][=N][C][=C][C][=C][S][C][Ring1][Branch1][=N][Ring1][=Branch2][C][=N][C][=C][S][Ring1][Branch1]
|
c15ncc2ccsc2n1.[C@H]16COCCN15.c17nccs1.C[C@H]47.C36=O.N34
|
Cn1ccnc1SCC(=O)N[C@H]1CCN(C(=O)c2ccn3nccc3c2)C12CC2
|
Cnccnc5SCC=O)N[C@H]CCNC=O)cccnnccc5c9))))))))))C5CC3
|
[C][N][C][=C][N][=C][Ring1][Branch1][S][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][N][N][=C][C][=C][Ring1][Branch1][C][=Ring1][=Branch2][C][Ring1][S][C][C][Ring1][Ring1]
|
c18ccn2nccc2c1.[C@H]17CCN5C12CC2.Cn1ccnc19.C6C4=O.C58=O.S69.N47
|
Cn1cc(NC(=O)[C@@H]2C[C@@H](F)CN2C(=O)Cc2[nH]nc3c(Cl)cccc23)nn1
|
CnccNC=O)[C@@H]C[C@@H]F)CN5C=O)Cc[nH]nccCl)cccc96))))))))))))))))))nn5
|
[C][N][C][=C][Branch2][Ring2][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][NH1][N][=C][C][Branch1][C][Cl][=C][C][=C][C][=Ring1][#Branch2][Ring1][#Branch1][N][=N][Ring2][Ring1][O]
|
c18[nH]nc2c(Cl)cccc12.[C@@H]17C[C@@H](F)CN15.Cn1cc6nn1.C5(=O)C8.C47=O.N46
|
CC12CCC(C(=O)NC[C@@H]3[C@H]4CCC[C@H]3N(C(=O)Cn3cnnn3)C4)(CC1)CO2
|
CCCCCC=O)NC[C@@H][C@H]CCC[C@H]6NC=O)Cncnnn5)))))))C7)))))))))))CC6))CO6
|
[C][C][C][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][C@H1][C][C][C][C@H1][Ring1][=Branch1][N][Branch1][=N][C][=Branch1][C][=O][C][N][C][=N][N][=N][Ring1][Branch1][C][Ring1][#C][Branch1][=Branch1][C][C][Ring2][Ring1][#Branch2][C][O][Ring2][Ring1][N]
|
CC12CCC8(CC1)CO2.[C@@H]1%10[C@H]2CCC[C@H]1N6C2.n19cnnn1.C6(=O)C9.C58=O.N57.C7%10
|
O=C1CCCC[C@@H](C(=O)NC2(c3cc(F)ccc3F)CCCC2)C1
|
O=CCCCC[C@@H]C=O)NCcccF)ccc6F)))))))CCCC5)))))))C7
|
[O][=C][C][C][C][C][C@@H1][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][Branch1][=N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][C][C][C][C][Ring1][=N][C][Ring2][Ring1][#Branch1]
|
O=C1CCCC[C@@H]6C1.c17cc(F)ccc1F.C157CCCC1.C46=O.N45
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1CCC[C@@H]1C(C)C
|
CcccScnccn5C)))))))ccc6NC=O)NCCC[C@@H]5CC)C
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][Branch1][C][C][C]
|
Cc1cc8ccc15.c17nccn1C.N14CCC[C@@H]16.C34=O.C6(C)C.S78.N35
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1C[C@@H](O)C[C@]1(C)CO
|
CcccScnccn5C)))))))ccc6NC=O)NC[C@@H]O)C[C@]5C)CO
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C@][Ring1][=Branch1][Branch1][C][C][C][O]
|
Cc1cc8ccc15.N14C[C@@H](O)C[C@@]16C.c17nccn1C.C34=O.S78.N35.C6O
|
COC[C@H]1CCN(C(=O)Nc2ccc(Sc3nccn3C)cc2)C1
|
COC[C@H]CCNC=O)NccccScnccn5C)))))))cc6))))))))C5
|
[C][O][C][C@H1][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][C][=C][Ring1][=N][C][Ring2][Ring1][Branch1]
|
c17ccc%10cc1.[C@H]18CCN4C1.c19nccn1C.C45=O.CO6.C68.N57.S9%10
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1CCC[C@H]1C
|
CcccScnccn5C)))))))ccc6NC=O)NCCC[C@H]5C
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C]
|
Cc1cc7ccc15.c16nccn1C.N14CCC[C@H]1C.C34=O.S67.N35
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1CC[C@@H](NC(N)=O)C1
|
CcccScnccn5C)))))))ccc6NC=O)NCC[C@@H]NCN)=O)))C5
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][N][=O][C][Ring1][=Branch2]
|
Cc1cc9ccc16.c18nccn1C.N14CC[C@@H]7C1.C34=O.C5(N)=O.S89.N36.N57
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1[C@@H](C)CCC1(C)C
|
CcccScnccn5C)))))))ccc6NC=O)N[C@@H]C)CCC5C)C
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][Ring1][=Branch1][Branch1][C][C][C]
|
Cc1cc7ccc15.N14[C@@H](C)CCC1(C)C.c16nccn1C.C34=O.S67.N35
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1CC[C@@H]([S@](C)(=N)=O)C1
|
CcccScnccn5C)))))))ccc6NC=O)NCC[C@@H][S@]C)=N)=O))C5
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=Branch2][S@][Branch1][C][C][=Branch1][C][=N][=O][C][Ring1][=Branch2]
|
N14CC[C@@H]([S@](C)(=N)=O)C1.Cc1cc7ccc15.c16nccn1C.C34=O.S67.N35
|
CO[C@@H]1C[C@H](CSC)N(C(=O)Nc2ccc(Sc3nccn3C)cc2C)C1
|
CO[C@@H]C[C@H]CSC)))NC=O)NccccScnccn5C)))))))cc6C)))))))))C5
|
[C][O][C@@H1][C][C@H1][Branch1][Ring2][C][S][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][C][=C][Ring1][=N][C][C][Ring2][Ring1][=Branch2]
|
c18ccc%11cc1C.[C@@H]16C[C@H]9N4C1.c1%10nccn1C.C45=O.CO6.C79.S7C.N58.S%10%11
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1CC[C@@H](CC(N)=O)C1
|
CcccScnccn5C)))))))ccc6NC=O)NCC[C@@H]CCN)=O)))C5
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][Ring1][=Branch2]
|
Cc1cc8ccc15.c17nccn1C.N14CC[C@@H]6C1.C6C(N)=O.C34=O.S78.N35
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1C[C@@H](CO)[C@@H](O)C1
|
CcccScnccn5C)))))))ccc6NC=O)NC[C@@H]CO))[C@@H]O)C5
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C][Ring1][Branch2]
|
Cc1cc8ccc15.N14C[C@@H]6[C@@H](O)C1.c17nccn1C.C34=O.S78.N35.C6O
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1CC[C@@H](F)C1
|
CcccScnccn5C)))))))ccc6NC=O)NCC[C@@H]F)C5
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][F][C][Ring1][=Branch1]
|
Cc1cc7ccc15.c16nccn1C.N14CC[C@@H](F)C1.C34=O.S67.N35
|
C#C[C@@H]1CCN(C(=O)Nc2ccc(Sc3nccn3C)cc2C)C1
|
C#C[C@@H]CCNC=O)NccccScnccn5C)))))))cc6C)))))))))C5
|
[C][#C][C@@H1][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][C][=C][Ring1][=N][C][C][Ring2][Ring1][=Branch1]
|
c16ccc8cc1C.C#C[C@@H]1CCN4C1.c17nccn1C.C45=O.N56.S78
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1C[C@@H](CO)C[C@H]1C
|
CcccScnccn5C)))))))ccc6NC=O)NC[C@@H]CO))C[C@H]5C
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][C@H1][Ring1][#Branch1][C]
|
Cc1cc8ccc15.N14C[C@@H]6C[C@H]1C.c17nccn1C.C34=O.S78.N35.C6O
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1CC[C@@](C)(N(C)C)C1
|
CcccScnccn5C)))))))ccc6NC=O)NCC[C@@]C)NC)C))C5
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][=Branch2]
|
Cc1cc8ccc16.N14CC[C@]5(C)C1.c17nccn1C.C34=O.N5(C)C.S78.N36
|
COC(=O)[C@@]1(CF)CCN(C(=O)Nc2ccc(Sc3nccn3C)cc2C)C1
|
COC=O)[C@@]CF))CCNC=O)NccccScnccn5C)))))))cc6C)))))))))C5
|
[C][O][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][F][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][C][=C][Ring1][=N][C][C][Ring2][Ring1][Branch2]
|
c17ccc%11cc1C.[C@]189CCN5C1.c1%10nccn1C.C48=O.C56=O.CO4.C9F.N67.S%10%11
|
Cc1cc(Sc2nccn2C)ccc1NC(=O)N1C[C@H](S(C)(=O)=O)CC1(C)C
|
CcccScnccn5C)))))))ccc6NC=O)NC[C@H]SC)=O)=O))CC5C)C
|
[C][C][=C][C][Branch1][#Branch2][S][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][N][C][C@H1][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][=Branch2][Branch1][C][C][C]
|
N14C[C@H](S(C)(=O)=O)CC1(C)C.Cc1cc7ccc15.c16nccn1C.C34=O.S67.N35
|
CCN1CC[C@H](NC(=O)CC2(N(C)C(=O)C[C@@H]3CNC(=O)O3)CC2)[C@H](C)C1
|
CCNCC[C@H]NC=O)CCNC)C=O)C[C@@H]CNC=O)O5))))))))CC3))))))[C@H]C)C6
|
[C][C][N][C][C][C@H1][Branch2][Ring2][C][N][C][=Branch1][C][=O][C][C][Branch2][Ring1][Ring2][N][Branch1][C][C][C][=Branch1][C][=O][C][C@@H1][C][N][C][=Branch1][C][=O][O][Ring1][=Branch1][C][C][Ring1][=C][C@H1][Branch1][C][C][C][Ring2][Ring1][=Branch2]
|
N16CC[C@H]8[C@H](C)C1.[C@@H]19CNC(=O)O1.C4(=O)C%10.C17%10CC1.C5(=O)C9.N57C.CC6.N48
|
C[C@@H]1CN(C)[C@H](C)C[C@H]1NC(=O)CC1(NC(=O)C[C@H]2CNC(=O)O2)CC1
|
C[C@@H]CNC)[C@H]C)C[C@H]6NC=O)CCNC=O)C[C@H]CNC=O)O5))))))))CC3
|
[C][C@@H1][C][N][Branch1][C][C][C@H1][Branch1][C][C][C][C@H1][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][Branch1][P][N][C][=Branch1][C][=O][C][C@H1][C][N][C][=Branch1][C][=O][O][Ring1][=Branch1][C][C][Ring1][=N]
|
C[C@@H]1CN(C)[C@H](C)C[C@H]16.[C@H]17CNC(=O)O1.C3(=O)C8.C158CC1.C4(=O)C7.N36.N45
|
C[C@@H]1C[C@H](N(C)C(=O)CC2(N(C)C(=O)C[C@H]3CNC(=O)O3)CC2)CCN1C
|
C[C@@H]C[C@H]NC)C=O)CCNC)C=O)C[C@H]CNC=O)O5))))))))CC3))))))CCN6C
|
[C][C@@H1][C][C@H1][Branch2][Ring2][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch2][Ring1][Ring2][N][Branch1][C][C][C][=Branch1][C][=O][C][C@H1][C][N][C][=Branch1][C][=O][O][Ring1][=Branch1][C][C][Ring1][=C][C][C][N][Ring2][Ring1][=Branch2][C]
|
C[C@@H]1C[C@H]7CCN1C.[C@H]18CNC(=O)O1.C4(=O)C9.C169CC1.C5(=O)C8.N47C.N56C
|
C[C@@H]1C[C@@H](NC(=O)CC2(NC(=O)C[C@H]3CNC(=O)O3)CC2)CCN1C
|
C[C@@H]C[C@@H]NC=O)CCNC=O)C[C@H]CNC=O)O5))))))))CC3))))))CCN6C
|
[C][C@@H1][C][C@@H1][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][C][Branch1][P][N][C][=Branch1][C][=O][C][C@H1][C][N][C][=Branch1][C][=O][O][Ring1][=Branch1][C][C][Ring1][=N][C][C][N][Ring2][Ring1][#Branch1][C]
|
C[C@@H]1C[C@@H]7CCN1C.[C@H]18CNC(=O)O1.C4(=O)C9.C169CC1.C5(=O)C8.N47.N56
|
O=C(NC[C@@H]1C[C@H](F)CN1c1nccn2nnnc12)c1ccc(C2CC2)nc1O
|
O=CNC[C@@H]C[C@H]F)CN5cnccnnnnc95))))))))))))))))ccccCCC3)))nc6O
|
[O][=C][Branch2][Ring1][#Branch2][N][C][C@@H1][C][C@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][=N][C][=C][N][N][=N][N][=C][Ring1][=Branch2][Ring1][Branch1][C][=C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][=C][Ring1][=Branch2][O]
|
c15nccn2nnnc12.c16ccc8nc1O.[C@@H]17C[C@H](F)CN15.O=C36.C18CC1.N34.C47
|
C[C@H](C[C@H]1CCOC1)NC(=O)c1cc(CNC(=O)C2=CCCCC2)cs1
|
C[C@H]C[C@H]CCOC5))))))NC=O)cccCNC=O)C=CCCCC6)))))))))cs5
|
[C][C@H1][Branch1][=Branch2][C][C@H1][C][C][O][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][C][C][C][C][Ring1][=Branch1][=C][S][Ring1][#C]
|
C4(=O)C1=CCCCC1.c17cc9cs1.[C@H]18CCOC1.C[C@@H]5C8.C37=O.N35.C69.N46
|
C[C@@H]1OC(=O)N[C@@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2
|
C[C@@H]OC=O)N[C@@H]5C=O)NCC[C@@]C5)CNC=O)CCCCCC6))CC6)))))))CCO6
|
[C][C@@H1][O][C][=Branch1][C][=O][N][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch2][C][C][O][Ring1][P]
|
N14CC[C@@]2(C1)CN5CCO2.C127CCC(CC1)CC2.C[C@@H]1OC(=O)N[C@@H]16.C46=O.C57=O
|
O=C(CCN(C(=O)[C@@H]1CC2(CCO1)CC2)C1CC1)NC1(CO)CC1
|
O=CCCNC=O)[C@@H]CCCCO6)))CC3))))))CCC3))))))NCCO))CC3
|
[O][=C][Branch2][Ring1][=C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch1][C][C][C][Ring1][Ring1][N][C][Branch1][Ring1][C][O][C][C][Ring1][Branch1]
|
[C@@H]18CC2(CCO1)CC2.O=C3CC5.C169CC1.N457.C48=O.C17CC1.N36.C9O
|
O=C(CCN(C(=O)[C@H]1CC2(CCO1)CC2)C1CC1)NC1(CCF)CC1
|
O=CCCNC=O)[C@H]CCCCO6)))CC3))))))CCC3))))))NCCCF)))CC3
|
[O][=C][Branch2][Ring1][=C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch1][C][C][C][Ring1][Ring1][N][C][Branch1][Ring2][C][C][F][C][C][Ring1][=Branch1]
|
[C@H]18CC2(CCO1)CC2.O=C3CC5.C169CC1.N457.C48=O.C17CC1.C9CF.N36
|
C[C@H](CCNC(=O)[C@H]1CC(c2cccnc2)=NO1)N(C)C(=O)C[C@@H]1C=CCCC1
|
C[C@H]CCNC=O)[C@H]CCccccnc6))))))=NO5)))))))))NC)C=O)C[C@@H]C=CCCC6
|
[C][C@H1][Branch2][Ring1][=Branch2][C][C][N][C][=Branch1][C][=O][C@H1][C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=N][O][Ring1][O][N][Branch1][C][C][C][=Branch1][C][=O][C][C@@H1][C][=C][C][C][C][Ring1][=Branch1]
|
[C@H]17CC(c2cccnc2)=NO1.[C@@H]18C=CCCC1.C[C@@H]5CC6.C4(=O)C8.C37=O.N45C.N36
|
O=C(C[C@@H]1Cc2ccccc2CN1Cc1ccc(I)o1)NCc1cocn1
|
O=CC[C@@H]Ccccccc6CN%10CccccI)o5)))))))))))))))))NCccocn5
|
[O][=C][Branch2][Ring1][O][C][C@@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][#Branch2][C][C][=C][C][=C][Branch1][C][I][O][Ring1][=Branch1][N][C][C][=C][O][C][=N][Ring1][Branch1]
|
[C@@H]16Cc2ccccc2CN14.c17ccc(I)o1.c18cocn1.O=C3C6.C47.N35.C58
|
Cc1ncccc1NC(=O)c1cncc(NCc2ccc3nccnc3c2)c1
|
Ccncccc6NC=O)ccnccNCccccnccnc6c%10))))))))))))c6
|
[C][C][=N][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][P][N][C][C][=C][C][=C][N][=C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2][=C][Ring2][Ring1][C]
|
c19ccc2nccnc2c1.Cc1ncccc16.c18cncc7c1.C48=O.N46.N57.C59
|
C[C@H](c1ccccc1)S(=O)(=O)NC(=O)[C@H]1CSCN1C(=O)C1CCC1
|
C[C@H]cccccc6))))))S=O)=O)NC=O)[C@H]CSCN5C=O)CCCC4
|
[C][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=Branch1][C][=O][C@H1][C][S][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2]
|
C[C@H]7S4(=O)=O.c17ccccc1.[C@H]15CSCN13.C16CCC1.C25=O.C36=O.N24
|
CCCC[C@H](c1ccccc1)S(=O)(=O)NC(=O)[C@H]1CSCN1C(=O)C1CCC1
|
CCCC[C@H]cccccc6))))))S=O)=O)NC=O)[C@H]CSCN5C=O)CCCC4
|
[C][C][C][C][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=Branch1][C][=O][C@H1][C][S][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2]
|
CCCC[C@H]7S4(=O)=O.c17ccccc1.[C@H]15CSCN13.C16CCC1.C25=O.C36=O.N24
|
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