SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
C[C@H](C(=O)N[C@@H](Cc1cnn(C)c1O)C(=O)NCCC[C@H](O)CO)c1ccsc1
|
C[C@H]C=O)N[C@@H]CccnnC)c5O)))))))C=O)NCCC[C@H]O)CO)))))))))))cccsc5
|
[C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][O][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][C][O][C][O][C][C][=C][S][C][=Ring1][Branch1]
|
c17cnn(C)c1O.C5CC[C@H](O)CO.[C@H]4(C7)C3=O.C[C@@H]6C2=O.c16ccsc1.N24.N35
|
CCOc1cccc(C(=O)NCCN2CCCN(C(=O)CCCC(C)=O)CC2)c1
|
CCOcccccC=O)NCCNCCCNC=O)CCCCC)=O))))))CC7)))))))))))c6
|
[C][C][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][N][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][=O][C][C][Ring1][#C][=C][Ring2][Ring1][#Branch2]
|
N18CCCN4CC1.C4(=O)CCCC(C)=O.c16cccc9c1.C39=O.C7C8.CC5.O56.N37
|
COC1(C)CN(CC(=O)NC[C@@H]2CCCC[C@@H]2NC(=O)CC2CC3(CCC3)C2)C1
|
COCC)CNCC=O)NC[C@@H]CCCC[C@@H]6NC=O)CCCCCCC4)))C4)))))))))))))))))C4
|
[C][O][C][Branch1][C][C][C][N][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch1][C][Ring2][Ring1][O]
|
[C@@H]1%10CCCC[C@@H]19.C1%11CC2(CCC2)C1.C16(C)CN7C1.C7C4=O.C5(=O)C%11.CO6.N48.C8%10.N59
|
O=C(NCCN1C[C@H]2C[C@@H]2C1)C1=CCN(C(=O)COCCF)C1
|
O=CNCCNC[C@H]C[C@@H]3C6)))))))))C=CCNC=O)COCCF))))))C5
|
[O][=C][Branch1][=C][N][C][C][N][C][C@H1][C][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][=C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][O][C][C][F][C][Ring1][N]
|
O=C3C1=CCN4C1.N18C[C@H]2C[C@@H]2C1.C4(=O)C5.C7C8.C6CF.N37.O56
|
CN(Cc1cn(-c2cccc(N)c2)nn1)C(=O)[C@H]1CCCC(=O)CC1
|
CNCccn-cccccN)c6))))))nn5))))))C=O)[C@H]CCCC=O)CC7
|
[C][N][Branch2][Ring1][=Branch1][C][C][=C][N][Branch1][N][C][=C][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1][N][=N][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][C][C][=Branch1][C][=O][C][C][Ring1][Branch2]
|
[C@H]15CCCC(=O)CC1.c17cccc(N)c1.c16cn7nn1.CN34.C35=O.C46
|
CC(C(=O)NC[C@@H](C)[C@H](F)C(=O)NCc1ccnn1C(C)C)=C1CC1
|
CCC=O)NC[C@@H]C)[C@H]F)C=O)NCcccnn5CC)C)))))))))))))))=CCC3
|
[C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][C][=C][C][=N][N][Ring1][Branch1][C][Branch1][C][C][C][=C][C][C][Ring1][Ring1]
|
C4[C@@H](C)[C@H](F)C3=O.c18ccnn17.CC=6C2=O.C7(C)C.C1=6CC1.N24.N35.C58
|
Cc1c(Cl)cc(C(=O)NCCCN2CCC[C@H](CO)C2)cc1Cl
|
CccCl)ccC=O)NCCCNCCC[C@H]CO))C6)))))))))))cc6Cl
|
[C][C][=C][Branch1][C][Cl][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][N][C][C][C][C@H1][Branch1][Ring1][C][O][C][Ring1][Branch2][C][=C][Ring2][Ring1][Branch1][Cl]
|
Cc1c(Cl)cc6cc1Cl.N15CCC[C@H]7C1.C4CC5.C36=O.N34.C7O
|
CC(C)(CNC(=O)c1cnc(S)nc1)CC1CN(C(=O)CC[C@@H]2CCCOC2)C1
|
CCC)CNC=O)ccncS)nc6)))))))))CCCNC=O)CC[C@@H]CCCOC6)))))))))C4
|
[C][C][Branch1][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][S][N][=C][Ring1][#Branch1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][Ring1][=C]
|
c16cnc(S)nc1.CC(C)(C5)C7.[C@@H]18CCCOC1.C17CN4C1.C4(=O)CC8.C36=O.N35
|
CC(C)C1=NO[C@@H](C(=O)N2CC[C@H]3[C@H](CCN3C(=O)CC(F)F)C2)C1
|
CCC)C=NO[C@@H]C=O)NCC[C@H][C@H]CCN5C=O)CCF)F)))))))C6)))))))C5
|
[C][C][Branch1][C][C][C][=N][O][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C@H1][C@H1][Branch1][S][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][Branch1][C][F][F][C][Ring1][#C][C][Ring2][Ring1][=Branch1]
|
N14CC[C@H]2[C@H](CCN25)C1.CC(C)C1=NO[C@@H]6C1.C5(=O)CC(F)F.C46=O
|
COCC(C)(C)N(C)C(=O)[C@@H]1CC12CCN(CCSc1ccccc1)CC2
|
COCCC)C)NC)C=O)[C@@H]CC3CCNCCScccccc6)))))))))CC6
|
[C][O][C][C][Branch1][C][C][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][N][Branch1][N][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][#C]
|
[C@@H]18CC12CCN6CC2.c19ccccc1.C4C5(C)C.N35C.C38=O.C6C7.CO4.S79
|
C/C(=C\C(C)(C)C)C(=O)N1C[C@]23CCC[C@@]2(C1)CN(C(=O)[C@H](C)C1CC1)C3
|
C/C=C\CC)C)C)))C=O)NC[C@]CCC[C@@]5C8)CNC=O)[C@H]C)CCC3)))))C8
|
[C][/C][=Branch1][#Branch2][=C][\C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@][C][C][C][C@@][Ring1][Branch1][Branch1][Ring2][C][Ring1][Branch2][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring1][S]
|
N14C[C@]23CCC[C@@]2(C1)CN5C3.CC=6C4=O.C=6C(C)(C)C.C5(=O)[C@@H]7C.C17CC1
|
CCC[C@@H](OC)C(=O)N1C[C@H](N=[N+]=[N-])C[C@@H]1C(=O)N1[C@@H]2CC[C@H]1C[C@@H](O)C2
|
CCC[C@@H]OC))C=O)NC[C@H]N=[N+]=[N-])))C[C@@H]5C=O)N[C@@H]CC[C@H]5C[C@@H]O)C7
|
[C][C][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring2][N][=N+1][=N-1][C][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C][C@@H1][Branch1][C][O][C][Ring1][Branch2]
|
N13C[C@H](N=[N+]=[N-])C[C@@H]16.N14[C@@H]2CC[C@H]1C[C@@H](O)C2.CCC[C@@H]5C3=O.C46=O.O5C
|
O=C([C@@H]1CCc2n[nH]cc2C1)N1CC=C(CNC(=O)[C@@]2(O)CCSC2)CC1
|
O=C[C@@H]CCcn[nH]cc5C9)))))))))NCC=CCNC=O)[C@@]O)CCSC5))))))))CC6
|
[O][=C][Branch1][=C][C@@H1][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][Ring1][=Branch2][N][C][C][=C][Branch1][P][C][N][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][S][C][Ring1][=Branch1][C][C][Ring1][S]
|
[C@@H]16CCc2n[nH]cc2C1.N13CC=C(C5)CC1.[C@]17(O)CCSC1.O=C36.C47=O.N45
|
O=C(N[C@@H](C1CC1)C(F)(F)F)[C@H]1CN(Cc2cnc(Cl)nc2Cl)CC(F)(F)C1
|
O=CN[C@@H]CCC3)))CF)F)F))))[C@H]CNCccncCl)nc6Cl))))))))CCF)F)C6
|
[O][=C][Branch2][Ring1][C][N][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F][C@H1][C][N][Branch1][=C][C][C][=C][N][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][Cl][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][P]
|
[C@H]16CN5CC(F)(F)C1.c18cnc(Cl)nc1Cl.[C@H]47C(F)(F)F.O=C36.C17CC1.N34.C58
|
CCNC(=O)c1ccc(CNC(=O)C(=O)NC[C@H](C)N2CCOC[C@@H]2C)cc1
|
CCNC=O)ccccCNC=O)C=O)NC[C@H]C)NCCOC[C@@H]6C))))))))))))))cc6
|
[C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][C][=C][Ring2][Ring1][#Branch1]
|
c1%10ccc%11cc1.N19CCOC[C@@H]1C.C4(=O)C5=O.C8[C@@H]9C.C3%10=O.CC6.N36.C7%11.N47.N58
|
O=C1C[C@@H](NC(=O)[C@]23CO[C@H](C2)[C@H](NC(=O)C2(F)CC=CC2)C3)CN1
|
O=CC[C@@H]NC=O)[C@]CO[C@H]C5)[C@H]NC=O)CF)CC=CC5)))))))C6))))))))CN5
|
[O][=C][C][C@@H1][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][C@][C][O][C@H1][Branch1][Ring2][C][Ring1][Branch1][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][Branch1][C][F][C][C][=C][C][Ring1][=Branch1][C][Ring1][S][C][N][Ring2][Ring1][Branch2]
|
[C@]128CO[C@H](C1)[C@H]7C2.O=C1C[C@@H]6CN1.C19(F)CC=CC1.C48=O.C59=O.N46.N57
|
CCCCn1nccc1C(=O)N1C[C@H](NC(=O)C(C)(F)F)[C@@H](C2CC2)C1
|
CCCCnnccc5C=O)NC[C@H]NC=O)CC)F)F))))[C@@H]CCC3)))C5
|
[C][C][C][C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][F][F][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][#C]
|
N13C[C@H](C2CC2)[C@@H]5C1.n17nccc16.C4(=O)C(C)(F)F.CCCC7.C36=O.N45
|
CSC(C)(C)COC(=O)c1ccc(CC(C)(C)C)cc1
|
CSCC)C)COC=O)ccccCCC)C)C)))cc6
|
[C][S][C][Branch1][C][C][Branch1][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][O]
|
c15ccc6cc1.C4(C)(C)C3.C6C(C)(C)C.C25=O.CS4.O23
|
CCC[C@H](C)CC(=O)N[C@H]1C[C@H](NC(=O)CC[C@H]2CCCO2)C1
|
CCC[C@H]C)CC=O)N[C@H]C[C@H]NC=O)CC[C@H]CCCO5)))))))))C4
|
[C][C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][C@H1][C][C][C][O][Ring1][Branch1][C][Ring1][=C]
|
CCC[C@H](C)CC3=O.[C@H]15C[C@H]6C1.C4(=O)CC7.[C@H]17CCCO1.N35.N46
|
CC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)[C@H](C)CCO)C2
|
CC=O)NCCC[C@@H]5C=O)N[C@@H]C[C@H]C[C@@H]C6)NC=O)[C@H]C)CCO)))))C5
|
[C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][N][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][O][C][Ring1][=N]
|
[C@@H]16C[C@H]2C[C@@H](C1)N5C2.C5(=O)[C@H](C)CCO.N13CCC[C@@H]17.CC3=O.C47=O.N46
|
N#CCC(=O)N1CC[C@@H]2CN(C(=O)[C@@]3(O)CCc4ccccc4C3)C[C@@H]2C1
|
N#CCC=O)NCC[C@@H]CNC=O)[C@@]O)CCcccccc6C%10)))))))))))C[C@@H]5C9
|
[N][#C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@@][Branch1][C][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][C][C@@H1][Ring2][Ring1][C][C][Ring2][Ring1][=Branch1]
|
[C@]17(O)CCc2ccccc2C1.N15CC[C@@H]2CN6C[C@@H]2C1.N#CCC5=O.C67=O
|
CCN(CCNC(=O)c1c(F)cccc1NC(C)=O)C(=O)CSc1cccs1
|
CCNCCNC=O)ccF)cccc6NCC)=O)))))))))))))C=O)CSccccs5
|
[C][C][N][Branch2][Ring1][=Branch2][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][C][S][C][=C][C][=C][S][Ring1][Branch1]
|
c1%11c%10cccc1F.c13cccs1.C5(=O)C9.N567.C7C8.C2%11=O.C4(C)=O.CC6.N28.N4%10.S93
|
COc1c(Cl)ncnc1N1C[C@H]2CN(C(=O)C3=NOC(C)(C)C3)C[C@H]2C1
|
COccCl)ncnc6NC[C@H]CNC=O)C=NOCC)C)C5))))))C[C@H]5C8
|
[C][O][C][=C][Branch1][C][Cl][N][=C][N][=C][Ring1][#Branch1][N][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][C][C@H1][Ring1][=C][C][Ring1][P]
|
N16C[C@H]2CN4C[C@H]2C1.C4(=O)C1=NOC(C)(C)C1.c15c6ncnc1Cl.CO5
|
Cc1nc([C@@H](NCc2ccc(O)c(F)c2)c2ccc(F)cc2)no1
|
Ccnc[C@@H]NCccccO)cF)c6))))))))ccccF)cc6)))))))no5
|
[C][C][=N][C][Branch2][Ring1][#C][C@@H1][Branch1][P][N][C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][F][=C][Ring1][Branch2][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][O][Ring2][Ring1][#Branch1]
|
c17ccc(O)c(F)c1.c16ccc(F)cc1.Cc1nc5no1.[C@@H]356.N34.C47
|
Cc1cnoc1C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2N1C(=O)c1c(F)ccc(N)c1F
|
Cccnoc5C=O)NC[C@@H]C[C@@H]COC[C@@H]5N8C=O)ccF)cccN)c6F
|
[C][C][C][=N][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][C][O][C][C@@H1][Ring1][Branch1][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][Branch1][C][N][=C][Ring1][Branch2][F]
|
[C@@H]18C[C@@H]2COC[C@@H]2N14.c17c(F)ccc(N)c1F.Cc1cnoc16.C36=O.C47=O.N35.C58
|
C[C@@H]1[C@@H](NC(=O)c2cc(=O)cc[nH]2)CCN1C(=O)Cc1sccc1Br
|
C[C@@H][C@@H]NC=O)ccc=O)cc[nH]6))))))))CCN5C=O)Ccsccc5Br
|
[C][C@@H1][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][C][=C][NH1][Ring1][#Branch1][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][C][S][C][=C][C][=Ring1][Branch1][Br]
|
C[C@@H]1[C@@H]5CCN14.c16cc(=O)cc[nH]1.c17sccc1Br.C4(=O)C7.C36=O.N35
|
CN(CCOCCNC(=O)CO[C@@H]1CCCOC1)C(=O)[C@H]1OCCOC12CCC2
|
CNCCOCCNC=O)CO[C@@H]CCCOC6)))))))))))))))C=O)[C@H]OCCOC6CCC4
|
[C][N][Branch2][Ring1][Branch1][C][C][O][C][C][N][C][=Branch1][C][=O][C][O][C@@H1][C][C][C][O][C][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][O][C][C][O][C][Ring1][=Branch1][C][C][C][Ring1][Ring2]
|
[C@H]1%11OCCOC12CCC2.[C@@H]18CCCOC1.C3(=O)C7.CN49.C9C5.C6C%10.C4%11=O.O56.N3%10.O78
|
O=C(NCCC1CC1)[C@@H](c1ccc2ccccc2c1)N1CCO[C@@H](CCF)C1
|
O=CNCCCCC3))))))[C@@H]ccccccccc6c%10))))))))))NCCO[C@@H]CCF)))C6
|
[O][=C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][Ring1][C@@H1][Branch1][#C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][N][C][C][O][C@@H1][Branch1][Ring2][C][C][F][C][Ring1][=Branch2]
|
c18ccc2ccccc2c1.N15CCO[C@@H]6C1.O=C3[C@H]58.C4C7.C17CC1.C6CF.N34
|
C=C1CCN(C(=O)[C@@H]2CC(C)(C)CCN2C(=O)c2snnc2CC)C1
|
C=CCCNC=O)[C@@H]CCC)C)CCN6C=O)csnnc5CC)))))))))))))))C5
|
[C][=C][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@@H1][C][C][Branch1][C][C][Branch1][C][C][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][S][N][=N][C][=Ring1][Branch1][C][C][C][Ring2][Ring1][Branch2]
|
[C@@H]15CC(C)(C)CCN14.C=C1CCN3C1.c16snnc17.C35=O.C46=O.C7C
|
CC[C@H](C)CC(=O)NC[C@@]12C[C@H]1CN(C(=O)c1cc([N+](=O)[O-])cc(C)n1)C2
|
CC[C@H]C)CC=O)NC[C@@]C[C@H]3CNC=O)ccc[N+]=O)[O-]))ccC)n6)))))))C6
|
[C][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@][C][C@H1][Ring1][Ring1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][Branch1][C][C][=N][Ring1][#Branch2][C][Ring2][Ring1][C]
|
c16cc([N+](=O)[O-])cc(C)n1.CC[C@H](C)CC3=O.[C@@]127C[C@H]1CN4C2.C46=O.N35.C57
|
COC[C@](C)(CCO)NC(=O)CCn1cc(CCC(=O)CCO)nn1
|
COC[C@]C)CCO)))NC=O)CCnccCCC=O)CCO))))))nn5
|
[C][O][C][C@][Branch1][C][C][Branch1][Ring2][C][C][O][N][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][#Branch2][C][C][C][=Branch1][C][=O][C][C][O][N][=N][Ring1][N]
|
C3[C@]4(C)CCO.C6CC(=O)CCO.n15cc6nn1.C2(=O)CC5.CO3.N24
|
CCc1c(C(=O)N2CCC(N(Cc3cnccc3C)CC3CC3)CC2)cnn1C
|
CCccC=O)NCCCNCccnccc6C))))))))CCCC3)))))CC6)))))))cnn5C
|
[C][C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][N][Branch1][O][C][C][=C][N][=C][C][=C][Ring1][=Branch1][C][C][C][C][C][Ring1][Ring1][C][C][Ring2][Ring1][Ring1][C][=N][N][Ring2][Ring1][#Branch2][C]
|
c19c8cnn1C.N14CCC7CC1.c1%11cnccc1C.C48=O.N567.C1%10CC1.CC9.C5%11.C6%10
|
C[C@@H](CNC(=O)c1cc2c(F)cccc2[nH]1)CN(C)C(=O)C[C@@H](O)C1CC1
|
C[C@@H]CNC=O)ccccF)cccc6[nH]9))))))))))))CNC)C=O)C[C@@H]O)CCC3
|
[C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C][C][C][Ring1][Ring1]
|
c17cc2c(F)cccc2[nH]1.C4(=O)C[C@H]8O.C[C@@H](C5)C6.C37=O.N46C.C18CC1.N35
|
CCc1ccoc1C(=O)N1C[C@H]2C[C@@H]1[C@H]2NC(=O)[C@H]1CCC(=O)N1C
|
CCcccoc5C=O)NC[C@H]C[C@@H]5[C@H]4NC=O)[C@H]CCC=O)N5C
|
[C][C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Ring1][Branch1][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C]
|
N13C[C@H]2C[C@@H]1[C@H]25.[C@H]16CCC(=O)N1C.c18ccoc17.C37=O.C46=O.CC8.N45
|
Cc1c(NC(=O)N2CCCC[C@@H]2c2ccc(F)cn2)cnn1CC(F)F
|
CccNC=O)NCCCC[C@@H]6ccccF)cn6))))))))))))))cnn5CCF)F
|
[C][C][=C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][=N][N][Ring2][Ring1][Branch1][C][C][Branch1][C][F][F]
|
Cc1c5cnn16.N14CCCC[C@@H]17.c17ccc(F)cn1.C6C(F)F.C34=O.N35
|
CCOCc1nc(C2CC(Cl)(Cl)C2)n(-c2cc(F)c(Br)cc2C)n1
|
CCOCcncCCCCl)Cl)C4))))n-cccF)cBr)cc6C)))))))n5
|
[C][C][O][C][C][N][=C][Branch1][=N][C][C][C][Branch1][C][Cl][Branch1][C][Cl][C][Ring1][=Branch1][N][Branch1][S][C][=C][C][Branch1][C][F][=C][Branch1][C][Br][C][=C][Ring1][Branch2][C][N][=Ring2][Ring1][Ring2]
|
c16cc(F)c(Br)cc1C.c15nc7n6n1.C17CC(Cl)(Cl)C1.CC3.O34.C45
|
CCc1cc(C(=O)N2CCN(C(=O)CCn3ccnc3C(C)C)[C@H](CC)C2)no1
|
CCcccC=O)NCCNC=O)CCnccnc5CC)C))))))))))[C@H]CC))C6)))))))no5
|
[C][C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][N][C][=C][N][=C][Ring1][Branch1][C][Branch1][C][C][C][C@H1][Branch1][Ring1][C][C][C][Ring2][Ring1][Ring2][=N][O][Ring2][Ring1][O]
|
N14CCN5[C@H]8C1.c19cc6no1.n17ccnc1%10.C5(=O)CC7.C46=O.C%10(C)C.CC9.C8C
|
O=C1CC[C@H](N(C(=O)C2CCSCC2)C2CCC3(CC2)CNC3)C(=O)N1
|
O=CCC[C@H]NC=O)CCCSCC6)))))))CCCCCC6))CNC4))))))))C=O)N6
|
[O][=C][C][C][C@H1][Branch2][Ring1][#C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][S][C][C][Ring1][=Branch1][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring2][Ring1][=Branch2]
|
C16CCC2(CC1)CNC2.O=C1CC[C@H]5C(=O)N1.C17CCSCC1.N456.C47=O
|
C#CC[C@@H](CC(F)F)C(=O)N1CC[C@@H](N(CC2CC2)C(=O)C=C(Cl)Cl)C1
|
C#CC[C@@H]CCF)F)))C=O)NCC[C@@H]NCCCC3))))C=O)C=CCl)Cl)))))C5
|
[C][#C][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring2][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][Cl][C][Ring1][S]
|
C#CC[C@@H](CC(F)F)C3=O.N13CC[C@@H]6C1.C4(=O)C=C(Cl)Cl.N456.C17CC1.C57
|
CCCCC(=O)C(=O)N[C@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3[C@@H]2C(=O)N1CCC[C@@H](COCC)C1
|
CCCCC=O)C=O)N[C@H][C@H]C[C@@H][C@H]5[C@@H]3[C@@H]6C=O)NCCC[C@@H]COCC))))C6
|
[C][C][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][C@H1][C][C@@H1][C@H1][Ring1][Branch1][C@@H1][Ring1][Ring1][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][Branch1][C][O][C][C][C][Ring1][#Branch2]
|
CCCCC(=O)C4=O.[C@H]18[C@H]2C[C@H]3[C@@H]([C@@H]29)[C@@H]13.N15CCC[C@@H]%10C1.C59=O.N48.C6%10.O67.C7C
|
C[C@@]1(C(=O)N[C@H]2C=CCN(C(=O)c3nccn4ccnc34)C2)CCCC1(F)F
|
C[C@@]C=O)N[C@H]C=CCNC=O)cnccnccnc95))))))))))C6))))))))CCCC5F)F
|
[C][C@@][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][=C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][C][=C][N][C][=C][N][=C][Ring1][=Branch2][Ring1][Branch1][C][Ring1][P][C][C][C][C][Ring2][Ring1][=Branch2][Branch1][C][F][F]
|
c18nccn2ccnc12.C[C@@]19CCCC1(F)F.[C@H]17C=CCN6C1.C59=O.C68=O.N57
|
C=Cn1nncc1C(=O)NCC(C)(C)C(=O)NCC[C@@H]1CCC[C@@H]2C[C@@H]12
|
C=Cnnncc5C=O)NCCC)C)C=O)NCC[C@@H]CCC[C@@H]C[C@@H]73
|
[C][=C][N][N][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][C@@H1][C][C@@H1][Ring1][#Branch1][Ring1][Ring1]
|
C=Cn1nncc17.C5C(C)(C)C4=O.[C@@H]18CCC[C@@H]2C[C@H]21.C37=O.C6C8.N35.N46
|
CCc1[nH]nc(C(=O)N2C[C@H]3C[C@H]2CN(C(=O)c2ccsc2COC)C3)c1Cl
|
CCc[nH]ncC=O)NC[C@H]C[C@H]5CNC=O)cccsc5COC)))))))))C6)))))))))c5Cl
|
[C][C][C][NH1][N][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Branch1][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][O][C][C][Ring1][S][C][=Ring2][Ring1][=Branch2][Cl]
|
N14C[C@H]2C[C@H]1CN5C2.c19[nH]nc7c1Cl.c18ccsc1%10.C47=O.C58=O.CC9.C6%10.O6C
|
CCCN(Cc1cccc2c(C)coc12)c1ccc(Cl)c(C)c1
|
CCCNCccccccC)coc95))))))))))ccccCl)cC)c6
|
[C][C][C][N][Branch2][Ring1][C][C][C][=C][C][=C][C][C][Branch1][C][C][=C][O][C][Ring1][#Branch2][=Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][C][=C][Ring1][Branch2]
|
c16cccc2c(C)coc12.c15ccc(Cl)c(C)c1.CCC3.N345.C46
|
CCn1ccc(C(=O)NC(C)(C)CCCNC(=O)c2cccc3scnc23)n1
|
CCncccC=O)NCC)C)CCCNC=O)cccccscnc95)))))))))))))))))n5
|
[C][C][N][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][S][C][=N][C][Ring1][=Branch2][=Ring1][Branch1][=N][Ring2][Ring1][#Branch2]
|
c19cccc2scnc12.C6(C)(C)CCC7.n1%10ccc8n1.C48=O.C59=O.CC%10.N46.N57
|
O=C(Nc1cnc2n1CCNC2)[C@H]1CNC[C@@H]1C(F)(F)F
|
O=CNccncn5CCNC6))))))))))[C@H]CNC[C@@H]5CF)F)F
|
[O][=C][Branch1][#C][N][C][=C][N][=C][N][Ring1][Branch1][C][C][N][C][Ring1][=Branch1][C@H1][C][N][C][C@@H1][Ring1][Branch1][C][Branch1][C][F][Branch1][C][F][F]
|
c14cnc2n1CCNC2.[C@H]15CNC[C@@H]16.C6(F)(F)F.O=C35.N34
|
CN([C@@H]1CCc2cc(Cl)ccc21)[C@@H](C(=O)NCC(F)F)c1nc(C2CCC2)no1
|
CN[C@@H]CCcccCl)ccc69)))))))))[C@@H]C=O)NCCF)F)))))cncCCCC4))))no5
|
[C][N][Branch1][P][C@@H1][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring1][#Branch2][C@@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][C][F][F][C][=N][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][=N][O][Ring1][=Branch2]
|
CN4[C@@H]1CCc2cc(Cl)ccc21.c16nc7no1.[C@@H]46C3=O.C5C(F)F.C17CCC1.N35
|
Cn1cnc2nc(=N[C@@H]3CC[C@@H](P(C)(C)=O)C3)[nH]c(NCCn3cc(Br)nn3)c21
|
Cncncnc=N[C@@H]CC[C@@H]PC)C)=O))C5))))))[nH]cNCCnccBr)nn5))))))))c69
|
[C][N][C][=N][C][=N][C][=Branch2][Ring1][Ring1][=N][C@@H1][C][C][C@@H1][Branch1][=Branch2][P][Branch1][C][C][Branch1][C][C][=O][C][Ring1][=Branch2][NH1][C][Branch1][=C][N][C][C][N][C][=C][Branch1][C][Br][N][=N][Ring1][=Branch1][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][N]
|
Cn1cnc2nc(=N[C@@H]3CC[C@@H](P(C)(C)=O)C3)[nH]c5c21.n16cc(Br)nn1.C4C6.N45
|
COCC(C)(C)C(=O)NC1CCC(NC(=O)c2coc(C(=O)OC)n2)CC1
|
COCCC)C)C=O)NCCCCNC=O)ccocC=O)OC)))n5)))))))CC6
|
[C][O][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=N][Ring1][=Branch2][C][C][Ring2][Ring1][C]
|
C6C(C)(C)C4=O.C17CCC8CC1.c19coc%10n1.C59=O.C3%10=O.CO6.N47.N58.O3C
|
C[C@H]1CN(C(=NCCc2ccoc2)NCCF)C[C@H](C)S1(=O)=O
|
C[C@H]CNC=NCCcccoc5))))))))NCCF)))))C[C@H]C)S6=O)=O
|
[C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][O][=N][C][C][C][C][=C][O][C][=Ring1][Branch1][N][C][C][F][C][C@H1][Branch1][C][C][S][Ring2][Ring1][Ring2][=Branch1][C][=O][=O]
|
C[C@H]1CN(C(=NCC4)N3)C[C@H](C)S1(=O)=O.c14ccoc1.C3CF
|
C=CC1(C2(C(=O)NC[C@](C)(NC(=O)CCc3cnoc3)C(C)C)CCC2)CCC1
|
C=CCCC=O)NC[C@]C)NC=O)CCccnoc5)))))))))CC)C))))))CCC4))))CCC4
|
[C][=C][C][Branch2][Ring2][#Branch2][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][C][=N][O][C][=Ring1][Branch1][C][Branch1][C][C][C][C][C][C][Ring2][Ring1][#Branch1][C][C][C][Ring2][Ring1][O]
|
C=CC1(C28CCC2)CCC1.C6[C@@]7(C)C(C)C.C5(=O)CC9.c19cnoc1.C48=O.N46.N57
|
CC(C)CN(C)CCCNC(=O)[C@@H]1CNC(=O)CN1C(=O)CCCCCN(C)C
|
CCC)CNC)CCCNC=O)[C@@H]CNC=O)CN6C=O)CCCCCNC)C
|
[C][C][Branch1][C][C][C][N][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][N][C][=Branch1][C][=O][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][C][C][N][Branch1][C][C][C]
|
[C@@H]18CNC(=O)CN13.C3(=O)CCCCC7.CC(C)C4.C5CC6.N45C.C28=O.N7(C)C.N26
|
C=CC[C@H](CNC(=O)COc1ccc(Cl)nc1)NC(=O)[C@H](C)c1ccc(Cl)s1
|
C=CC[C@H]CNC=O)COccccCl)nc6)))))))))))NC=O)[C@H]C)ccccCl)s5
|
[C][=C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1]
|
c15ccc(Cl)nc1.C=CC[C@@H]6C7.c18ccc(Cl)s1.C3(=O)[C@@H]8C.C2(=O)C4.N27.O45.N36
|
O=C(C[C@@]1(O)CCOC1)N[C@@H]1CCN(c2ncnc(Cl)c2Br)CC12CCC2
|
O=CC[C@@]O)CCOC5))))))N[C@@H]CCNcncncCl)c6Br)))))))CC6CCC4
|
[O][=C][Branch1][N][C][C@@][Branch1][C][O][C][C][O][C][Ring1][=Branch1][N][C@@H1][C][C][N][Branch1][=N][C][=N][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][Br][C][C][Ring1][=C][C][C][C][Ring1][Ring2]
|
[C@@H]15CCN4CC12CCC2.c14ncnc(Cl)c1Br.[C@]16(O)CCOC1.O=C3C6.N35
|
CC(C)c1ccc(CC(=O)NC2(CNC(=O)[C@@H]3CCCC(F)(F)C3)CC2)cc1
|
CCC)ccccCC=O)NCCNC=O)[C@@H]CCCCF)F)C6)))))))))CC3))))))cc6
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2][C][C][Ring1][#C][C][=C][Ring2][Ring1][=Branch2]
|
[C@@H]18CCCC(F)(F)C1.c1%10ccc%11cc1.C%11C4=O.C169CC1.CC%10C.C58=O.N46.C79.N57
|
Cn1cc(C(=O)N2CCC[C@H](NC(=O)c3cscc3F)CC2)c(C2CCCC2)n1
|
CnccC=O)NCCC[C@H]NC=O)ccscc5F))))))))CC7))))))))cCCCCC5)))))n5
|
[C][N][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][F][C][C][Ring1][S][C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][=N][Ring2][Ring1][N]
|
N14CCC[C@H]6CC1.Cn1cc7c9n1.c18cscc1F.C19CCCC1.C47=O.C58=O.N56
|
CSCC(=O)NCCCN(C(=O)CN(C)CC(=O)NC(C)C)C1CCCC1
|
CSCC=O)NCCCNC=O)CNC)CC=O)NCC)C))))))))CCCCC5
|
[C][S][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][C][C][C][C][Ring1][Branch1]
|
C13CCCC1.C%11C2=O.C6CC7.C4(=O)C8.C9C5=O.N473.N89C.C%10(C)C.CS%11.N26.N5%10
|
Cc1ncc(CC(=O)NCC[C@]23CC[C@H]2CN(C(=O)c2c[nH]c(=N)o2)C3)[nH]1
|
CcnccCC=O)NCC[C@]CC[C@H]4CNC=O)cc[nH]c=N)o5))))))C7))))))))))))[nH]5
|
[C][C][=N][C][=C][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@][C][C][C@H1][Ring1][Ring2][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=N][O][Ring1][=Branch1][C][Ring1][#C][NH1][Ring2][Ring1][#Branch2]
|
[C@]129CC[C@H]1CN5C2.Cc1ncc8[nH]1.c17c[nH]c(=N)o1.C8C4=O.C6C9.C57=O.N46
|
C[C@@H]1C[C@H](NC(=O)C2(CNC(=O)Cc3cncnc3O)CC=CC2)CCN1C
|
C[C@@H]C[C@H]NC=O)CCNC=O)Cccncnc6O)))))))))))CC=CC5)))))))CCN6C
|
[C][C@@H1][C][C@H1][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][Branch1][P][C][N][C][=Branch1][C][=O][C][C][=C][N][=C][N][=C][Ring1][=Branch1][O][C][C][=C][C][Ring1][P][C][C][N][Ring2][Ring1][#Branch2][C]
|
C[C@@H]1C[C@H]7CCN1C.c1%10cncnc1O.C189CC=CC1.C5(=O)C%10.C48=O.N47.C69.N56
|
Cn1cncc1C(=O)NCCCCC(=O)N1CCOC[C@@H]1C(F)F
|
Cncncc5C=O)NCCCCC=O)NCCOC[C@@H]6CF)F
|
[C][N][C][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][Branch1][C][F][F]
|
C4CCCC3=O.N13CCOC[C@@H]16.Cn1cncc15.C25=O.C6(F)F.N24
|
C#C[C@@H]1CCN1C(=O)[C@@H](F)CC(C)(C)NC(=O)[C@H](C)OCCOCC
|
C#C[C@@H]CCN4C=O)[C@@H]F)CCC)C)NC=O)[C@H]C)OCCOCC
|
[C][#C][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][C][O][C][C]
|
C2(=O)[C@@H](F)CC8(C)C.C#C[C@@H]1CCN12.C3(=O)[C@@H]4C.C5C6.N38.O45.O67.C7C
|
CCC1CC(CC(=O)N2CCC3(CC2)CCN(C(=O)[C@@H]2CNC(=O)N2C)C3)C1
|
CCCCCCC=O)NCCCCC6))CCNC=O)[C@@H]CNC=O)N5C)))))))C5))))))))))C4
|
[C][C][C][C][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][C][N][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][Ring1][S][C][Ring2][Ring1][#Branch2]
|
N14CCC2(CC1)CCN5C2.[C@@H]16CNC(=O)N1C.C17CC8C1.C8C4=O.C56=O.CC7
|
Cc1coc(C(=O)N[C@H]2C[C@H]3CC[C@@H]([C@H]2C)N3c2nncs2)c1C
|
CccocC=O)N[C@H]C[C@H]CC[C@@H][C@H]7C))N5cnncs5))))))))))))))c5C
|
[C][C][=C][O][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@H1][C][C@H1][C][C][C@@H1][Branch1][Branch1][C@H1][Ring1][#Branch1][C][N][Ring1][#Branch1][C][=N][N][=C][S][Ring1][Branch1][=C][Ring2][Ring1][=Branch1][C]
|
[C@H]16C[C@H]2CC[C@@H]([C@H]1C)N25.Cc1coc7c1C.c15nncs1.C47=O.N46
|
CC[C@@](C)(CNC(=O)CN(C(=O)CCCN(C)C)C1CCC1)COC
|
CC[C@@]C)CNC=O)CNC=O)CCCNC)C))))))CCCC4)))))))))COC
|
[C][C][C@@][Branch1][C][C][Branch2][Ring1][=N][C][N][C][=Branch1][C][=O][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][N][Branch1][C][C][C][C][C][C][C][Ring1][Ring2][C][O][C]
|
CC[C@](C)(C4)C5.C3(=O)CCC7.C2(=O)C6.C18CCC1.N368.N7(C)C.N25.O4C
|
CCC(C)(CC)C(=O)N(C)C1CCN(C(=O)CCc2c(C)noc2Cl)CC1
|
CCCC)CC))C=O)NC)CCCNC=O)CCccC)noc5Cl)))))))))CC6
|
[C][C][C][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][=N][O][C][=Ring1][=Branch1][Cl][C][C][Ring1][P]
|
CCC(C)(CC)C3=O.C15CCN4CC1.c16c(C)noc1Cl.C4(=O)CC6.N35C
|
C=CC[C@@]1(NC(=O)[C@@H](C)CO)CCN(C(=O)c2c(F)cccc2SC)C1
|
C=CC[C@@]NC=O)[C@@H]C)CO)))))CCNC=O)ccF)cccc6SC)))))))))C5
|
[C][=C][C][C@@][Branch1][N][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][S][C][C][Ring2][Ring1][#Branch1]
|
c16c8cccc1F.[C@@]157CCN4C1.C3(=O)[C@@H](C)CO.C=CC7.C46=O.N35.S8C
|
CCOC(=O)[C@]1(C(=O)NCC(C)(C)CNC(=O)CC(C(C)C)C(C)C)CC12CC2
|
CCOC=O)[C@]C=O)NCCC)C)CNC=O)CCCC)C))CC)C)))))))))))CC3CC3
|
[C][C][O][C][=Branch1][C][=O][C@][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][=Branch1][C][C][Ring1][Ring1]
|
C5(=O)CC(C(C)C)C(C)C.[C@@]19%10CC12CC2.C7C(C)(C)C8.C39=O.C4%10=O.CC6.O36.N47.N58
|
COc1cccc(C)c1C(=O)NCCCCN=c1[nH]cnc2cc(C)ccc12
|
COcccccC)c6C=O)NCCCCN=c[nH]cncccC)ccc%106
|
[C][O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][N][=C][NH1][C][=N][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][O][Ring1][#Branch1]
|
C5CCCN=c1[nH]cnc2cc(C)ccc12.c14cccc(C)c16.C36=O.CO4.N35
|
CNC(=O)CCC(=O)N1CC2(C1)CN(C(=O)c1cccc3c1OCCN3)CCO2
|
CNC=O)CCC=O)NCCC4)CNC=O)cccccc6OCCN6)))))))))))CCO6
|
[C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][N][Ring1][=Branch1][C][C][O][Ring2][Ring1][Ring1]
|
N15CC2(C1)CN6CCO2.c17cccc2c1OCCN2.C4(=O)CCC5=O.C67=O.CN4
|
Cc1cc(S(N)(=O)=O)oc1C(=O)N1CC[C@@H](C)[C@@H]1CNC(=O)c1cnc(S)[nH]1
|
CcccSN)=O)=O))oc5C=O)NCC[C@@H]C)[C@@H]5CNC=O)ccncS)[nH]5
|
[C][C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][O][C][=Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][S][NH1][Ring1][=Branch1]
|
Cc1cc(S(N)(=O)=O)oc15.N12CC[C@@H](C)[C@@H]17.c16cnc(S)[nH]1.C25=O.C36=O.C47.N34
|
CCCc1cc(C(=O)N2CCO[C@H](CCNC(=O)Cc3nnc(O)s3)C2)no1
|
CCCcccC=O)NCCO[C@H]CCNC=O)CcnncO)s5))))))))))C6)))))))no5
|
[C][C][C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=N][N][=C][Branch1][C][O][S][Ring1][=Branch1][C][Ring2][Ring1][C][=N][O][Ring2][Ring1][=Branch2]
|
N14CCO[C@H]8C1.c19cc7no1.c1%10nnc(O)s1.C5(=O)C%10.CCC9.C47=O.C8C6.N56
|
Cc1nc(Cl)sc1C(=O)NC[C@]1(O)CCCN(C(=O)[C@H]2CCC[C@@H](C)C2)C1
|
CcncCl)sc5C=O)NC[C@]O)CCCNC=O)[C@H]CCC[C@@H]C)C6)))))))C6
|
[C][C][N][=C][Branch1][C][Cl][S][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch1][C][Ring1][S]
|
[C@@]18(O)CCCN4C1.Cc1nc(Cl)sc16.[C@H]17CCC[C@@H](C)C1.C36=O.C47=O.N35.C58
|
C=CC[C@H](CNC(=O)C1(C(=O)N2CCCC2)CC1)NC(=O)c1cnc(CCC)s1
|
C=CC[C@H]CNC=O)CC=O)NCCCC5))))))CC3))))))NC=O)ccncCCC)))s5
|
[C][=C][C][C@H1][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][C][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring2][C][C][C][S][Ring1][Branch2]
|
C=CC[C@@H]6C7.c18cnc%11s1.N14CCCC1.C19%10CC1.C39=O.C4%10=O.C58=O.C%11CC.N37.N56
|
COc1ncc(C(=O)NC[C@@](C)(CO)NC(=O)[C@@H](C)Cc2ccnn2C)c(C)n1
|
COcnccC=O)NC[C@@]C)CO))NC=O)[C@@H]C)Ccccnn5C))))))))))))))cC)n6
|
[C][O][C][=N][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=C][C][=N][N][Ring1][Branch1][C][C][Branch1][C][C][=N][Ring2][Ring1][O]
|
c15ncc8c(C)n1.C6[C@@]7(C)CO.C4(=O)[C@@H](C)C9.c19ccnn1C.C38=O.CO5.N36.N47
|
O=C(NC[C@H]1CCC[C@@H](NC(=O)[C@@H](O)C2CCCCCCC2)C1)c1ccc(F)s1
|
O=CNC[C@H]CCC[C@@H]NC=O)[C@@H]O)CCCCCCCC8)))))))))))C6))))))))ccccF)s5
|
[O][=C][Branch2][Ring2][C][N][C][C@H1][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][C][C][C][C][C][Ring1][Branch2][C][Ring2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][S][Ring1][=Branch1]
|
C19CCCCCCC1.[C@H]18CCC[C@@H]6C1.c17ccc(F)s1.C4(=O)[C@H]9O.O=C37.N35.C58.N46
|
CC(C)(C)[C@H](O)C(=O)N[C@@]12C[C@H]3CC[C@@H]([C@@H]1C2)N3C(=O)c1csnc1Cl
|
CCC)C)[C@H]O)C=O)N[C@@]C[C@H]CC[C@@H][C@@H]7C8))N5C=O)ccsnc5Cl
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@@][C][C@H1][C][C][C@@H1][Branch1][#Branch1][C@@H1][Ring1][#Branch1][C][Ring1][Branch2][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][S][N][=C][Ring1][Branch1][Cl]
|
[C@@]126C[C@H]3CC[C@@H]([C@@H]1C2)N35.CC(C)(C)[C@H](O)C4=O.c17csnc1Cl.C57=O.N46
|
Cc1ccc(CO)c(NC(=O)[C@H](CNC(=O)[C@@H](F)C(C)(F)F)CC2CC2)c1
|
CccccCO))cNC=O)[C@H]CNC=O)[C@@H]F)CC)F)F))))))CCCC3)))))))c6
|
[C][C][=C][C][=C][Branch1][Ring1][C][O][C][Branch2][Ring2][C][N][C][=Branch1][C][=O][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][C][Branch1][C][F][F][C][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][#Branch2]
|
Cc1ccc8c6c1.C4(=O)[C@@H](F)C(C)(F)F.C3(=O)[C@H](C5)C7.C17CC1.C8O.N36.N45
|
CCCCCCn1nnnc1[C@@H](NCCCC(=O)OC)c1ccccc1C
|
CCCCCCnnnnc5[C@@H]NCCCC=O)OC)))))))cccccc6C
|
[C][C][C][C][C][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][O][N][C][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C]
|
c17ccccc1C.CCCCCC5.n15nnnc16.C4CCC2=O.[C@@H]367.N34.O2C
|
Cc1noc(CCNC(=O)c2ncoc2CNC(=O)[C@@H]2CC23CC3)n1
|
CcnocCCNC=O)cncoc5CNC=O)[C@@H]CC3CC3)))))))))))))))))n5
|
[C][C][=N][O][C][Branch2][Ring1][=C][C][C][N][C][=Branch1][C][=O][C][N][=C][O][C][=Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][Ring1][Ring1][=N][Ring2][Ring1][Branch2]
|
Cc1noc%10n1.c18ncoc1%11.[C@@H]19CC12CC2.C%10C6.C48=O.C59=O.N46.C7%11.N57
|
CN(C)c1nc(O)cc(C(=O)N[C@@H]2CN(C(=O)CC[C@@H]3CC3(C)C)CC[C@H]2O)n1
|
CNC)cncO)ccC=O)N[C@@H]CNC=O)CC[C@@H]CC3C)C)))))))CC[C@H]6O)))))))))n6
|
[C][N][Branch1][C][C][C][=N][C][Branch1][C][O][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C@@H1][C][C][Ring1][Ring1][Branch1][C][C][C][C][C][C@H1][Ring1][#C][O][=N][Ring2][Ring1][#Branch2]
|
c16nc8cc(O)n1.[C@@H]17CN5CC[C@H]1O.C5(=O)CC9.[C@@H]19CC1(C)C.CN6C.C48=O.N47
|
CC(C)N(CCNC(=O)CSCC(N)=O)C(=O)[C@@H]1S[C@H]2C=C[C@H]1CC2
|
CCC)NCCNC=O)CSCCN)=O)))))))))C=O)[C@@H]S[C@H]C=C[C@H]6CC6
|
[C][C][Branch1][C][C][N][Branch1][S][C][C][N][C][=Branch1][C][=O][C][S][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][C@@H1][S][C@H1][C][=C][C@H1][Ring1][=Branch1][C][C][Ring1][=Branch1]
|
[C@@H]1%10S[C@H]2C=C[C@H]1CC2.C3(=O)C8.C9C(N)=O.CC5C.N456.C6C7.C4%10=O.N37.S89
|
C=CC[C@@H](CNC(=O)Cc1cnccc1Cl)NC(=O)C1CCC(C)(C)CC1
|
C=CC[C@@H]CNC=O)Cccnccc6Cl)))))))))))NC=O)CCCCC)C)CC6
|
[C][=C][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][C][=C][N][=C][C][=C][Ring1][=Branch1][Cl][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2]
|
C16CCC(C)(C)CC1.c17cnccc1Cl.C=CC[C@H]4C5.C2(=O)C7.C36=O.N25.N34
|
CCCC[C@H](O)[C@H](C)C(=O)N1CC[C@@H]([C@@H](C)C(=O)N2CCC23CC(C)(CO)C3)C1
|
CCCC[C@H]O)[C@H]C)C=O)NCC[C@@H][C@@H]C)C=O)NCCC4CCC)CO))C4)))))))))C5
|
[C][C][C][C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring2][C][C][Branch1][C][C][Branch1][Ring1][C][O][C][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
CCCC[C@H](O)[C@H](C)C4=O.N15CCC12CC7(C)C2.N14CC[C@@H]6C1.[C@H]6(C)C5=O.C7O
|
Cc1ncc(C(=O)N2CCCCCC[C@@H]2C(=O)NCCC#CCO)c(=N)[nH]1
|
CcnccC=O)NCCCCCC[C@@H]8C=O)NCCC#CCO)))))))))))))))))c=N)[nH]6
|
[C][C][=N][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C][C][C][C][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][#C][C][O][C][=Branch1][C][=N][NH1][Ring2][Ring1][#Branch2]
|
N13CCCCCC[C@@H]16.Cc1ncc7c(=N)[nH]1.C5CC#CCO.C37=O.C46=O.N45
|
CNC(=O)NCc1cn([C@@H](C)CNC(=O)c2cnc(C(=O)OC)s2)nn1
|
CNC=O)NCccn[C@@H]C)CNC=O)ccncC=O)OC)))s5)))))))))nn5
|
[C][N][C][=Branch1][C][=O][N][C][C][=C][N][Branch2][Ring1][#Branch2][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][S][Ring1][=Branch2][N][=N][Ring2][Ring1][Ring2]
|
c14cn%12nn1.c1%10cnc%11s1.[C@H]%12(C)C9.C56=O.C7%10=O.C3%11=O.CN5.N68.C84.N79.O3C
|
CS[C@H]1C[C@H](C(=O)N[C@@H]2CCC[C@H](N(C)C(=O)CCc3cnco3)C2)C1
|
CS[C@H]C[C@H]C=O)N[C@@H]CCC[C@H]NC)C=O)CCccnco5)))))))))C6))))))))C4
|
[C][S][C@H1][C][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Branch2][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][N][=C][O][Ring1][Branch1][C][Ring1][P][C][Ring2][Ring1][Branch2]
|
[C@@H]16CCC[C@H]7C1.[C@H]1%10C[C@H]8C1.C5(=O)CC9.c19cnco1.C48=O.N57C.CS%10.N46
|
CCCC=C[C@@H](O)C(=O)N[C@H]1CCN(C(=O)Cc2ccc(O)cc2Cl)[C@H](C)C1
|
CCCC=C[C@@H]O)C=O)N[C@H]CCNC=O)CccccO)cc6Cl)))))))))[C@H]C)C6
|
[C][C][C][C][=C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][Cl][C@H1][Branch1][C][C][C][Ring2][Ring1][C]
|
[C@H]15CCN4[C@H](C)C1.c17ccc(O)cc1Cl.C=6[C@@H](O)C3=O.CCCC=6.C4(=O)C7.N35
|
Cc1nn(CCO)cc1C(=O)N[C@H]1CN(C(=O)c2ccsc2)C2(CCCC2)C1
|
CcnnCCO)))cc5C=O)N[C@H]CNC=O)cccsc5))))))CCCCC5))))C5
|
[C][C][=N][N][Branch1][Ring2][C][C][O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Ring1][S]
|
[C@H]15CN4C2(CCCC2)C1.Cc1nn8cc16.c17ccsc1.C8CO.C36=O.C47=O.N35
|
FC(F)Cn1nnnc1[C@@H](N[C@@H]1CSCc2ccccc21)c1occc1Br
|
FCF)Cnnnnc5[C@@H]N[C@@H]CSCcccccc6%10)))))))))))coccc5Br
|
[F][C][Branch1][C][F][C][N][N][=N][N][=C][Ring1][Branch1][C@@H1][Branch1][S][N][C@@H1][C][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][O][C][=C][C][=Ring1][Branch1][Br]
|
N3[C@@H]1CSCc2ccccc21.n14nnnc15.c16occc1Br.FC(F)C4.[C@@H]356
|
Cc1nc(C(=O)N[C@@H]2CN(C(=O)c3cccc[n+]3[O-])C(C)(C)C2)c(C)s1
|
CcncC=O)N[C@@H]CNC=O)ccccc[n+]6[O-]))))))))CC)C)C5)))))))cC)s5
|
[C][C][=N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=N+1][Ring1][=Branch1][O-1][C][Branch1][C][C][Branch1][C][C][C][Ring1][S][=C][Branch1][C][C][S][Ring2][Ring1][=Branch2]
|
[C@@H]16CN5C(C)(C)C1.Cc1nc7c(C)s1.c18cccc[n+]1[O-].C47=O.C58=O.N46
|
CC[C@H](CNC(=O)Cc1c(C)cccc1F)NC(=O)C=CC(=O)N(C)C
|
CC[C@H]CNC=O)CccC)cccc6F)))))))))))NC=O)C=CC=O)NC)C
|
[C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][F][N][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][N][Branch1][C][C][C]
|
c18c(C)cccc1F.CC[C@@H]5C6.C2(=O)C8.C3(=O)C=7.C=7C4=O.N4(C)C.N26.N35
|
CN1CC[C@](C)(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)C(C)(C)OCC(F)(F)F)C1
|
CNCC[C@]C)C=O)N[C@@H]CCCC[C@H]6NC=O)CC)C)OCCF)F)F)))))))))))))))C5
|
[C][N][C][C][C@][Branch1][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][O]
|
CN1CC[C@@]9(C)C1.[C@@H]17CCCC[C@H]18.C4(=O)C5(C)C.C6C(F)(F)F.C39=O.N37.N48.O56
|
COc1cccc(C(=O)N2C[C@H](CNC(=O)c3cc(C)c(O)nn3)[C@H]3C[C@H]32)c1F
|
COcccccC=O)NC[C@H]CNC=O)cccC)cO)nn6)))))))))[C@H]C[C@H]36)))))))c6F
|
[C][O][C][=C][C][=C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][O][N][=N][Ring1][Branch2][C@H1][C][C@H1][Ring1][Ring1][Ring2][Ring1][C][=C][Ring2][Ring1][#Branch2][F]
|
c16cccc9c1F.c18cc(C)c(O)nn1.N14C[C@H]%10[C@H]2C[C@H]21.C49=O.C58=O.CO6.C7%10.N57
|
C=C[C@H](O)C(=O)N1CC[C@H](CN(C)c2nc(Cl)ncc2F)C1
|
C=C[C@H]O)C=O)NCC[C@H]CNC)cncCl)ncc6F)))))))))C5
|
[C][=C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][C][C][N][Branch1][C][C][C][=N][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][F][C][Ring1][S]
|
c15nc(Cl)ncc1F.C=C[C@H](O)C3=O.N13CC[C@H]6C1.N45C.C46
|
C=CC(C)C(C)C(=O)NC(C)(C)CNC(=O)c1cnn(C)c1
|
C=CCC)CC)C=O)NCC)C)CNC=O)ccnnC)c5
|
[C][=C][C][Branch1][C][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
|
C=CC(C)C(C)C2=O.c16cnn(C)c1.C4(C)(C)C5.C36=O.N24.N35
|
CC(C)(O)Cn1cc(C2(NC(=O)[C@H]3CCn4c(O)nnc4C3)CC(F)(F)C2)nn1
|
CCC)O)CnccCNC=O)[C@H]CCncO)nnc5C9)))))))))))CCF)F)C4))))nn5
|
[C][C][Branch1][C][C][Branch1][C][O][C][N][C][=C][Branch2][Ring2][=Branch1][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][C][C][N][C][Branch1][C][O][=N][N][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][Ring1][N][=N][Ring2][Ring1][Branch2]
|
[C@H]17CCn2c(O)nnc2C1.C169CC(F)(F)C1.n18cc9nn1.CC(C)(O)C8.C57=O.N56
|
CC[C@]1(C(=O)NC/C=C/CNC(=O)[C@@H](CC(C)C)N(C)C)CCOC1
|
CC[C@]C=O)NC/C=C/CNC=O)[C@@H]CCC)C)))NC)C)))))))))))CCOC5
|
[C][C][C@][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][/C][=C][/C][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][Branch1][C][C][C][C][C][O][C][Ring2][Ring1][#Branch1]
|
C3(=O)[C@H]6CC(C)C.[C@]179CCOC1.C27=O.C4C=8.C=8C5.N6(C)C.CC9.N24.N35
|
CSC(SC)C(=O)NC1(CC(=O)NC2CC3(CCCCO3)C2)CCC1
|
CSCSC))C=O)NCCC=O)NCCCCCCCO6)))))C4)))))))CCC4
|
[C][S][C][Branch1][Ring1][S][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch2][C][C][C][C][O][Ring1][=Branch1][C][Ring1][=Branch2][C][C][C][Ring1][P]
|
C19CC2(CCCCO2)C1.C78C4=O.C16%10CCC1.C%10C5=O.CS7.S8C.N46.N59
|
C[C@@H]1CCCC[C@@H]1CC(=O)N[C@H]1CCN(C(=O)C=CCF)C[C@@H]1F
|
C[C@@H]CCCC[C@@H]6CC=O)N[C@H]CCNC=O)C=CCF)))))C[C@@H]6F
|
[C][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][=Branch2][C][=Branch1][C][=O][C][=C][C][F][C][C@@H1][Ring1][N][F]
|
[C@H]14CCN3C[C@@H]1F.C[C@@H]1CCCC[C@@H]16.C6C2=O.C3(=O)C=5.C=5CF.N24
|
COc1ccc(C[C@@H](C)CN(C)C[C@H](O)CCc2ccccc2)cc1
|
COccccC[C@@H]C)CNC)C[C@H]O)CCcccccc6))))))))))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][C@H1][Branch1][C][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1]
|
c13ccc6cc1.C5[C@H](O)CC7.c17ccccc1.C6[C@@H](C)C4.N45C.CO3
|
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