SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCC(=CC(=O)N1CCCN(C(=O)C2(CF)CC2)C[C@@H]1CO)CC
|
CCC=CC=O)NCCCNC=O)CCF))CC3))))C[C@@H]7CO)))))))))))CC
|
[C][C][C][=Branch2][Ring1][S][=C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][C][Ring1][Branch1][C][C@@H1][Ring1][=C][C][O][C][C]
|
N13CCCN4C[C@@H]17.CCC=6CC.C=6C3=O.C158CC1.C45=O.C8F.C7O
|
COc1cc(Cl)cc(C(=O)NCC2(CNC(=O)[C@H]3CCO[C@H](C(C)C)C3)CC2)c1
|
COcccCl)ccC=O)NCCCNC=O)[C@H]CCO[C@H]CC)C))C6)))))))))CC3))))))c6
|
[C][O][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@H1][C][C][O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring1][=Branch2][C][C][Ring1][S][=C][Ring2][Ring1][O]
|
c17cc%11cc(Cl)c1.[C@H]1%10CCO[C@H]%12C1.C1%135CC1.C4%11=O.C6%10=O.C%12(C)C.CO7.N48.C8%13.C95.N69
|
C[C@@H](C(=O)N1[C@H]2CC[C@H]1CC(C(=O)NCC[C@H]1OCCC1(C)C)C2)N1CCCC1
|
C[C@@H]C=O)N[C@H]CC[C@H]5CCC=O)NCC[C@H]OCCC5C)C))))))))))C7)))))))))NCCCC5
|
[C][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Ring1][Branch1][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@H1][O][C][C][C][Ring1][Branch1][Branch1][C][C][C][C][Ring2][Ring1][Ring1][N][C][C][C][C][Ring1][Branch1]
|
N13[C@H]2CC[C@H]1CC7C2.[C@H]18OCCC1(C)C.C[C@H]5C3=O.N15CCCC1.C47=O.C6C8.N46
|
Cc1ccc(N)c(C(=O)N2CCCC[C@H]2CNC(=O)[C@]2(F)C[C@H]2C)c1
|
CccccN)cC=O)NCCCC[C@H]6CNC=O)[C@]F)C[C@H]3C))))))))))))))c6
|
[C][C][=C][C][=C][Branch1][C][N][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@][Branch1][C][F][C][C@H1][Ring1][Ring2][C][=C][Ring2][Ring1][Branch2]
|
Cc1ccc(N)c7c1.N13CCCC[C@H]18.[C@@]16(F)C[C@H]1C.C37=O.C46=O.C58.N45
|
CC1(C#CC(=O)NC[C@H](NC(=O)[C@]2(CO)CCOC2)C2CCCC2)COC1
|
CCC#CC=O)NC[C@H]NC=O)[C@]CO))CCOC5)))))))CCCCC5)))))))))))COC4
|
[C][C][Branch2][Ring2][Ring1][C][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@][Branch1][Ring1][C][O][C][C][O][C][Ring1][#Branch1][C][C][C][C][C][Ring1][Branch1][C][O][C][Ring2][Ring1][#Branch2]
|
CC1(C#CC3=O)COC1.[C@@]179CCOC1.C18CCCC1.C5[C@H]68.C47=O.N35.N46.C9O
|
Cc1nn(C)c([C@H](NCc2cocn2)c2nnnn2C2CCCC2)c1Cl
|
CcnnC)c[C@H]NCccocn5)))))))cnnnn5CCCCC5)))))))))))c5Cl
|
[C][C][=N][N][Branch1][C][C][C][Branch2][Ring1][O][C@H1][Branch1][#Branch2][N][C][C][=C][O][C][=N][Ring1][Branch1][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C][C][Ring1][Branch1][=C][Ring2][Ring1][Branch2][Cl]
|
Cc1nn(C)c5c1Cl.c16nnnn18.c17cocn1.C18CCCC1.[C@H]356.N34.C47
|
O=C(Nc1nncs1)c1ccc(=NCc2ccc(Oc3cncnc3)cc2)[nH]c1
|
O=CNcnncs5))))))cccc=NCccccOccncnc6)))))))cc6))))))))[nH]c6
|
[O][=C][Branch1][=Branch2][N][C][=N][N][=C][S][Ring1][Branch1][C][C][=C][C][=Branch2][Ring1][=Branch1][=N][C][C][=C][C][=C][Branch1][#Branch2][O][C][=C][N][=C][N][=C][Ring1][=Branch1][C][=C][Ring1][=N][NH1][C][=Ring2][Ring1][Branch1]
|
c18ccc(=NC9)[nH]c1.c19ccc5cc1.c16cncnc1.c17nncs1.O=C48.N47.O56
|
O=C(NCCC[C@H]1CCCCN1C(=O)Cc1ccc(F)cn1)[C@@H]1CCO1
|
O=CNCCC[C@H]CCCCN6C=O)CccccF)cn6))))))))))))))))))[C@@H]CCO4
|
[O][=C][Branch2][Ring1][=N][N][C][C][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C@@H1][C][C][O][Ring1][Ring2]
|
[C@H]16CCCCN13.c17ccc(F)cn1.C4CC6.C3(=O)C7.[C@@H]15CCO1.O=C25.N24
|
Cc1noc(-c2cn(CC(=O)N[C@@H](CNC(=O)c3csc(C)c3)C3CC3)cn2)n1
|
Ccnoc-ccnCC=O)N[C@@H]CNC=O)ccscC)c5))))))))CCC3)))))))cn5)))))n5
|
[C][C][=N][O][C][Branch2][Ring2][#Branch2][C][=C][N][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Ring1][C][=N][Ring2][Ring1][#Branch1][=N][Ring2][Ring1][N]
|
Cc1noc%11n1.c1%11cn9cn1.c18csc(C)c1.C9C4=O.[C@@H]6%10C7.C58=O.C1%10CC1.N46.N57
|
COC[C@@]1(C(=O)N(C)CCCN=[N+]=[N-])C=CCN1C(=O)C(Cl)Cl
|
COC[C@@]C=O)NC)CCCN=[N+]=[N-]))))))))C=CCN5C=O)CCl)Cl
|
[C][O][C][C@@][Branch1][#C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][=N+1][=N-1][C][=C][C][N][Ring1][#C][C][=Branch1][C][=O][C][Branch1][C][Cl][Cl]
|
[C@@]167C=CCN13.C5CCN=[N+]=[N-].C3(=O)C(Cl)Cl.C26=O.N25C.CO4.C47
|
C#CC1CCN(C(=O)[C@@H](NC(=O)Cc2cnn(C)c2C)[C@@H](C)OC)CC1
|
C#CCCCNC=O)[C@@H]NC=O)CccnnC)c5C)))))))))[C@@H]C)OC)))))CC6
|
[C][#C][C][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C@@H1][Branch1][C][C][O][C][C][C][Ring2][Ring1][Branch2]
|
C#CC1CCN3CC1.C3(=O)[C@@H]6[C@H]5C.c17cnn(C)c1C.C4(=O)C7.N46.O5C
|
O=C(NC1(CNC(=O)[C@@H]2CC[C@@H]2c2nc(S)n[nH]2)CC1)c1nccc2ccsc12
|
O=CNCCNC=O)[C@@H]CC[C@@H]4cncS)n[nH]5))))))))))))CC3))))cncccccsc95
|
[O][=C][Branch2][Ring1][S][N][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Ring1][Ring2][C][=N][C][Branch1][C][S][=N][NH1][Ring1][=Branch1][C][C][Ring1][P][C][=N][C][=C][C][C][=C][S][C][Ring1][=Branch2][=Ring1][Branch1]
|
c17nccc2ccsc12.c1%10nc(S)n[nH]1.[C@@H]18CC[C@@H]1%10.C159CC1.O=C37.C48=O.N35.C69.N46
|
C[C@@H]1CCN(C(=O)C2(C(C)(C)O)CCC2)CCN1C(=O)CSc1n[nH]c(O)n1
|
C[C@@H]CCNC=O)CCC)C)O))CCC4)))))CCN7C=O)CScn[nH]cO)n5
|
[C][C@@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][O][C][C][C][Ring1][Branch2][C][C][N][Ring1][P][C][=Branch1][C][=O][C][S][C][=N][NH1][C][Branch1][C][O][=N][Ring1][=Branch1]
|
C[C@@H]1CCN3CCN14.c18n[nH]c(O)n1.C167CCC1.C7(C)(C)O.C4(=O)C5.C36=O.S58
|
C[C@H](C#N)C(=O)N(CC(=O)N1C[C@H](C)OC2(CCC2)C1)C1CC1
|
C[C@H]C#N))C=O)NCC=O)NC[C@H]C)OCCCC4)))C6))))))))CCC3
|
[C][C@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][Branch2][Ring1][Branch2][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][O][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch2][C][C][C][Ring1][Ring1]
|
N14C[C@H](C)OC2(CCC2)C1.C[C@H](C#N)C3=O.C5C4=O.N356.C16CC1
|
NC(=O)[C@@H]1CCCN1C(=O)C1CC(n2cc(CCC3(CCO)OCCO3)nn2)C1
|
NC=O)[C@@H]CCCN5C=O)CCCnccCCCCCO)))OCCO5)))))))nn5)))))C4
|
[N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][Branch2][Ring1][Branch2][N][C][=C][Branch1][#C][C][C][C][Branch1][Ring2][C][C][O][O][C][C][O][Ring1][Branch2][N][=N][Ring1][#C][C][Ring2][Ring1][Ring1]
|
[C@@H]15CCCN14.n1%10cc9nn1.C178OCCO1.C16CC%10C1.NC5=O.C46=O.C9C7.C8CO
|
C[C@@H]1[C@H]2C[C@H]([C@H]2NC(=O)[C@H](C)n2ccnc2)N1C(=O)CCn1cc(Br)cn1
|
C[C@@H][C@H]C[C@H][C@H]4NC=O)[C@H]C)nccnc5)))))))))N5C=O)CCnccBr)cn5
|
[C][C@@H1][C@H1][C][C@H1][Branch2][Ring1][Ring2][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=C][N][=C][Ring1][Branch1][N][Ring1][S][C][=Branch1][C][=O][C][C][N][C][=C][Branch1][C][Br][C][=N][Ring1][=Branch1]
|
C[C@@H]1[C@H]2C[C@H]([C@H]25)N14.n17cc(Br)cn1.C3(=O)[C@@H]6C.n16ccnc1.C4(=O)CC7.N35
|
C[C@@](CCCl)(NCCSC(F)F)c1nnnn1CCOCc1ccccc1
|
C[C@@]CCCl)))NCCSCF)F))))))cnnnn5CCOCcccccc6
|
[C][C@@][Branch1][Ring2][C][C][Cl][Branch1][#Branch2][N][C][C][S][C][Branch1][C][F][F][C][=N][N][=N][N][Ring1][Branch1][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C[C@@]48CCCl.c18nnnn17.c19ccccc1.S6C(F)F.C5C6.C7C2.N45.O23.C39
|
CC(C)C[C@@H](O)C(=O)N[C@H]1CCN(Cc2n[nH]c3ccccc23)C[C@H]1F
|
CCC)C[C@@H]O)C=O)N[C@H]CCNCcn[nH]cccccc96))))))))))C[C@H]6F
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][#C][C][C][=N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][C@H1][Ring1][S][F]
|
c17n[nH]c2ccccc12.CC(C)C[C@@H](O)C4=O.[C@H]16CCN5C[C@H]1F.N46.C57
|
C#CCCCC(=O)N1C[C@H](C(=O)Nc2cc(CO)ccc2C)[C@@H](F)C1
|
C#CCCCC=O)NC[C@H]C=O)NcccCO))ccc6C)))))))))[C@@H]F)C5
|
[C][#C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][Branch1][Ring1][C][O][=C][C][=C][Ring1][Branch2][C][C@@H1][Branch1][C][F][C][Ring2][Ring1][C]
|
c15cc7ccc1C.C#CCCCC3=O.N13C[C@H]6[C@@H](F)C1.C46=O.N45.C7O
|
CCc1ccccc1[C@H](CNC(C)=O)NC(=O)Cc1ccc(C2CCC2)cc1
|
CCcccccc6[C@H]CNCC)=O))))NC=O)CccccCCCC4))))cc6
|
[C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][Branch1][Branch2][C][N][C][Branch1][C][C][=O][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][=C][Ring1][#Branch2]
|
c17ccccc18.c19ccc%10cc1.[C@@H]58C6.C4(=O)C9.C1%10CCC1.C3(C)=O.CC7.N36.N45
|
CC(C)CC(=O)N1C[C@H](NC(=O)C2=CCCS2)CC[C@@H]1C
|
CCC)CC=O)NC[C@H]NC=O)C=CCCS5)))))))CC[C@@H]6C
|
[C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][C][S][Ring1][Branch1][C][C][C@@H1][Ring1][=C][C]
|
N13C[C@H]5CC[C@@H]1C.C4(=O)C1=CCCS1.CC(C)CC3=O.N45
|
C[C@H]1CN(C(=O)[C@@H]2COC3(C2)CN(C(=O)C2=C[C@H]4CC[C@@H](C2)C4)C3)CCN1C
|
C[C@H]CNC=O)[C@@H]COCC5)CNC=O)C=C[C@H]CC[C@@H]C7)C5))))))))C4))))))))CCN6C
|
[C][C@H1][C][N][Branch2][Ring2][Branch2][C][=Branch1][C][=O][C@@H1][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][C][Ring1][=Branch1][C][Ring1][#C][C][C][N][Ring2][Ring1][#Branch2][C]
|
C6(=O)C1=C[C@H]2CC[C@@H](C1)C2.[C@@H]17COC2(C1)CN6C2.C[C@H]1CN5CCN1C.C57=O
|
CCOCC(=O)N[C@@H]1CCCCN(C(=O)CCN2CCOCC2=O)C1
|
CCOCC=O)N[C@@H]CCCCNC=O)CCNCCOCC6=O))))))))))C7
|
[C][C][O][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][N][C][C][O][C][C][Ring1][=Branch1][=O][C][Ring2][Ring1][C]
|
[C@@H]17CCCCN4C1.N18CCOCC1=O.C4(=O)CC8.C6C3=O.CC5.O56.N37
|
C[C@H]1CN(C(=O)C(=O)N[C@@H](CF)c2ccccc2)C[C@H](C)S1
|
C[C@H]CNC=O)C=O)N[C@@H]CF))cccccc6))))))))))C[C@H]C)S6
|
[C][C@H1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Branch1][C][C][S][Ring2][Ring1][Branch1]
|
C[C@H]1CN3C[C@H](C)S1.c16ccccc1.C3(=O)C4=O.[C@@H]56CF.N45
|
COc1ccsc1[C@@H](C(=O)NCCSC)N1CCOC[C@@H]1CC(N)=O
|
COcccsc5[C@@H]C=O)NCCSC))))))NCCOC[C@@H]6CCN)=O
|
[C][O][C][C][=C][S][C][=Ring1][Branch1][C@@H1][Branch1][#Branch2][C][=Branch1][C][=O][N][C][C][S][C][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][C][Branch1][C][N][=O]
|
N14CCOC[C@@H]17.c13ccsc18.[C@H]48C2=O.C7C(N)=O.C5C6.CO3.N25.S6C
|
CCN(CCCNC(=O)c1nscc1C)C(=O)c1nc(C)oc1OC
|
CCNCCCNC=O)cnscc5C)))))))))))C=O)cncC)oc5OC
|
[C][C][N][Branch1][P][C][C][C][N][C][=Branch1][C][=O][C][=N][S][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][C][N][=C][Branch1][C][C][O][C][=Ring1][=Branch1][O][C]
|
c19nc(C)oc14.c18nscc1C.C6CC7.N356.C28=O.C39=O.CC5.N27.O4C
|
CC[C@](C)(OC)C(=O)N[C@@H]1C[C@H](O)[C@H]1CC(=O)N1CC(N(C)CCO)C1
|
CC[C@]C)OC))C=O)N[C@@H]C[C@H]O)[C@H]4CC=O)NCCNC)CCO))))C4
|
[C][C][C@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch1][C][O][C@H1][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][N][Branch1][C][C][C][C][O][C][Ring1][=Branch2]
|
CC[C@@]4(C)C2=O.[C@@H]16C[C@H](O)[C@H]18.N13CC7C1.C8C3=O.N57C.C5CO.O4C.N26
|
Cc1cc(N)c(C(=O)N[C@]23C[C@H]2CN(C(=O)CC[C@@H]2CCC(=O)NC2)C3)cc1C
|
CcccN)cC=O)N[C@]C[C@H]3CNC=O)CC[C@@H]CCC=O)NC6)))))))))C6))))))))cc6C
|
[C][C][=C][C][Branch1][C][N][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@][C][C@H1][Ring1][Ring1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][C][Ring1][P][C][=C][Ring2][Ring1][O][C]
|
Cc1cc(N)c7cc1C.[C@]126C[C@H]1CN5C2.[C@@H]18CCC(=O)NC1.C5(=O)CC8.C47=O.N46
|
CC[C@@]1(C(=O)N[C@H](C)c2nnnn2C)CCCN(C(=O)CCC2OCCO2)C1
|
CC[C@@]C=O)N[C@H]C)cnnnn5C)))))))))CCCNC=O)CCCOCCO5))))))))C6
|
[C][C][C@@][Branch2][Ring1][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][C][O][C][C][O][Ring1][Branch1][C][Ring2][Ring1][#Branch2]
|
[C@@]169CCCN4C1.c18nnnn1C.C4(=O)CC7.C17OCCO1.C36=O.[C@H]58C.CC9.N35
|
CN1CCOC2(C1)CN(C(=O)C1CC(CCNC(=O)CCC(=O)NN(C)C)C1)C2
|
CNCCOCC6)CNC=O)CCCCCNC=O)CCC=O)NNC)C))))))))))C4)))))C4
|
[C][N][C][C][O][C][Branch1][Ring2][C][Ring1][=Branch1][C][N][Branch2][Ring1][P][C][=Branch1][C][=O][C][C][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][N][Branch1][C][C][C][C][Ring1][P][C][Ring2][Ring1][Branch2]
|
CN1CCOC2(CN3C2)C1.C4(=O)CCC(=O)NN(C)C.C16CC7C1.C36=O.C7C5.N45
|
C[C@H](NC(=O)c1cn(CCNC(=O)[C@H]2C[C@@H](N(C)C)C2)nn1)[C@H]1CCCO1
|
C[C@H]NC=O)ccnCCNC=O)[C@H]C[C@@H]NC)C))C4))))))))nn5)))))))[C@H]CCCO5
|
[C][C@H1][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][C][=C][N][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][#Branch1][N][=N][Ring1][P][C@H1][C][C][C][O][Ring1][Branch1]
|
c18cn%10nn1.[C@H]19C[C@@H]7C1.[C@H]1%11CCCO1.C[C@H]5%11.C38=O.C%10C6.C49=O.N7(C)C.N35.N46
|
COCCCOCCC(=O)N[C@H](C)C(C)(C)C(=O)N[C@H]1CC(F)(F)C1(C)C
|
COCCCOCCC=O)N[C@H]C)CC)C)C=O)N[C@H]CCF)F)C4C)C
|
[C][O][C][C][C][O][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][Branch1][C][C][C]
|
[C@@H]7(C)C(C)(C)C3=O.[C@H]18CC(F)(F)C1(C)C.C6CC2=O.C4CC5.CO4.O56.N27.N38
|
CCOCCCC(=O)N(C)CC1CN(C(=O)[C@]2(C(F)(F)F)CC=CCO2)C1
|
CCOCCCC=O)NC)CCCNC=O)[C@]CF)F)F))CC=CCO6)))))))C4
|
[C][C][O][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][C][=C][C][O][Ring1][#Branch2][C][Ring1][S]
|
[C@@]189CC=CCO1.C6CCC3=O.C1%10CN4C1.C9(F)(F)F.N37C.C48=O.CC5.O56.C7%10
|
CC(C)CN1CCN(C(=O)[C@H]2CCO[C@H]2CNC(=O)CC2CC(=O)C2)CC1
|
CCC)CNCCNC=O)[C@H]CCO[C@H]5CNC=O)CCCC=O)C4))))))))))))))CC6
|
[C][C][Branch1][C][C][C][N][C][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][O][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][C][Ring1][Branch1][C][C][Ring2][Ring1][#Branch1]
|
N15CCN3CC1.[C@H]17CCO[C@H]18.C19CC(=O)C1.CC(C)C5.C4(=O)C9.C37=O.C68.N46
|
CCN1C(=O)CC[C@@H]1C(=O)NC[C@H](NC(=O)Cc1ccccc1Br)C1CC1
|
CCNC=O)CC[C@@H]5C=O)NC[C@H]NC=O)Ccccccc6Br))))))))))CCC3
|
[C][C][N][C][=Branch1][C][=O][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][C][C][C][Ring1][Ring1]
|
N17C(=O)CC[C@@H]16.c19ccccc1Br.C4[C@H]58.C3(=O)C9.C26=O.C18CC1.CC7.N24.N35
|
CSCCCCC(=O)NCCN1CCN(C(=O)CCOc2ccccc2O)CC1
|
CSCCCCC=O)NCCNCCNC=O)CCOcccccc6O)))))))))))CC6
|
[C][S][C][C][C][C][C][=Branch1][C][=O][N][C][C][N][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][C]
|
C9CCCC3=O.N18CCN4CC1.c16ccccc1O.C4(=O)CC5.C7C8.CS9.N37.O56
|
C[C@H](Nc1ccc(S(=O)(=O)NC2(C)CC(F)(F)C2)c(Cl)c1)[C@@H](C)n1cncn1
|
C[C@H]NccccS=O)=O)NCC)CCF)F)C4))))))cCl)c6)))))))[C@@H]C)ncncn5
|
[C][C@H1][Branch2][Ring2][Branch2][N][C][=C][C][=C][Branch2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][C][C@@H1][Branch1][C][C][N][C][=N][C][=N][Ring1][Branch1]
|
c16ccc(S5(=O)=O)c(Cl)c1.C14(C)CC(F)(F)C1.C[C@H]3[C@H]7C.n17cncn1.N36.N45
|
C[C@H]1CC=CC[C@@H]1NC(=O)/C=C/C1CCN(C(=O)[C@](C)(F)C(C)(C)F)CC1
|
C[C@H]CC=CC[C@@H]6NC=O)/C=C/CCCNC=O)[C@]C)F)CC)C)F))))CC6
|
[C][C@H1][C][C][=C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][/C][=C][/C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@][Branch1][C][C][Branch1][C][F][C][Branch1][C][C][Branch1][C][C][F][C][C][Ring1][#C]
|
C3(=O)[C@](C)(F)C(C)(C)F.C=5C1CCN3CC1.C[C@H]1CC=CC[C@@H]14.C2(=O)C=5.N24
|
N#Cc1c(Cl)cccc1NC(=O)Cc1ccccc1NCc1c(I)ccnc1Cl
|
N#CccCl)cccc6NC=O)Ccccccc6NCccI)ccnc6Cl
|
[N][#C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][=C][Branch1][C][I][C][=C][N][=C][Ring1][#Branch1][Cl]
|
N#Cc1c4cccc1Cl.c17c(I)ccnc1Cl.c16ccccc15.C2(=O)C6.N24.N35.C37
|
C=Cn1nccc1C(=O)N[C@H](CCc1ccccc1)[C@@H](C)NC(=O)/C=C(\C)CC
|
C=Cnnccc5C=O)N[C@H]CCcccccc6))))))))[C@@H]C)NC=O)/C=C\C)CC
|
[C][=C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][/C][=C][Branch1][C][\C][C][C]
|
C=Cn1nccc16.[C@@H]4(CC8)[C@H]5C.c18ccccc1.C3(=O)C=7.C=7(C)CC.C26=O.N24.N35
|
COC1(C(=O)N2CC(O)(CN(C)C(=O)Cc3nc(C)sc3C)C2)CCOCC1
|
COCC=O)NCCO)CNC)C=O)CcncC)sc5C))))))))))C4)))))CCOCC6
|
[C][O][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][C][Ring2][Ring1][C][C][C][O][C][C][Ring2][Ring1][#Branch2]
|
C168CCOCC1.c19nc(C)sc1C.N14CC%10(O)C1.C5(=O)C9.C48=O.N57C.CO6.C7%10
|
Cc1cc(N2CCS[C@@H](C)C2)nc(N[C@@H]2COc3cc(F)ccc32)n1
|
CcccNCCS[C@@H]C)C6))))))ncN[C@@H]COcccF)ccc69))))))))))n6
|
[C][C][=C][C][Branch1][N][N][C][C][S][C@@H1][Branch1][C][C][C][Ring1][#Branch1][=N][C][Branch2][Ring1][C][N][C@@H1][C][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][#Branch2][=N][Ring2][Ring1][Branch2]
|
N5[C@@H]1COc2cc(F)ccc21.Cc1cc4nc5n1.N14CCS[C@@H](C)C1
|
C[C@H](C(=O)NC[C@@]1(NC(=O)C2CC=CC2)CCCC[C@@H]1C)C1CCC1
|
C[C@H]C=O)NC[C@@]NC=O)CCC=CC5)))))))CCCC[C@@H]6C))))))))))CCCC4
|
[C][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@@][Branch1][=N][N][C][=Branch1][C][=O][C][C][C][=C][C][Ring1][Branch1][C][C][C][C][C@@H1][Ring1][=C][C][C][C][C][C][Ring1][Ring2]
|
[C@@]169CCCC[C@@H]1C.C[C@@H]8C3=O.C17CC=CC1.C18CCC1.C47=O.N35.C59.N46
|
CO[C@@H]1C[C@@H](C)CN(C(=O)[C@@H](Cc2cc[nH]n2)NC(=O)c2ccncc2N)C1
|
CO[C@@H]C[C@@H]C)CNC=O)[C@@H]Cccc[nH]n5))))))NC=O)cccncc6N)))))))))))C6
|
[C][O][C@@H1][C][C@@H1][Branch1][C][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C@@H1][Branch1][=Branch2][C][C][C][=C][NH1][N][=Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][Ring2][Ring1][#Branch2]
|
[C@@H]15C[C@@H](C)CN3C1.c17ccncc1N.C3(=O)[C@H]6C8.c18cc[nH]n1.C47=O.CO5.N46
|
CC[C@@H](C(=O)NCc1n[nH]cc1C(=O)N[C@@H]1CCC2(CCCC2)C1)C(C)C
|
CC[C@@H]C=O)NCcn[nH]cc5C=O)N[C@@H]CCCCCCC5))))C5)))))))))))))))CC)C
|
[C][C][C@@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Ring1][=Branch2][C][Branch1][C][C][C]
|
[C@@H]16CCC2(CCCC2)C1.CC[C@@H](C3=O)C(C)C.c18n[nH]cc17.C47=O.N35.C58.N46
|
CO[C@H](C)c1nc(Cl)cc(N2CCC[C@@H](CCNC(=O)c3nccc(C)n3)C2)n1
|
CO[C@H]C)cncCl)ccNCCC[C@@H]CCNC=O)cncccC)n6))))))))))C6))))))n6
|
[C][O][C@H1][Branch1][C][C][C][=N][C][Branch1][C][Cl][=C][C][Branch2][Ring1][#C][N][C][C][C][C@@H1][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][C][Ring2][Ring1][C][=N][Ring2][Ring1][=Branch2]
|
c19nc7cc(Cl)n1.N17CCC[C@@H]%10C1.c18nccc(C)n1.[C@H]59C.C%10C6.C48=O.CO5.N46
|
C=C(Br)CC(=O)N(C)[C@H](C)CNC(=O)[C@H](OC)c1c(F)cccc1F
|
C=CBr)CC=O)NC)[C@H]C)CNC=O)[C@H]OC))ccF)cccc6F
|
[C][=C][Branch1][C][Br][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][O][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F]
|
c17c(F)cccc1F.C=C(Br)CC2=O.C3(=O)[C@H]47.[C@@H]5(C)C6.N25C.N36.O4C
|
C=C[C@@H](C)CC(=O)N1CC[C@@H](CNC(=O)CC(P(C)(C)=O)P(C)(C)=O)C12CC2
|
C=C[C@@H]C)CC=O)NCC[C@@H]CNC=O)CCPC)C)=O))PC)C)=O)))))))C5CC3
|
[C][=C][C@@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][C][C][Branch1][=Branch2][P][Branch1][C][C][Branch1][C][C][=O][P][Branch1][C][C][Branch1][C][C][=O][C][Ring2][Ring1][Ring1][C][C][Ring1][Ring1]
|
C4(=O)CC(P(C)(C)=O)P(C)(C)=O.N13CC[C@@H]6C12CC2.C=C[C@@H](C)CC3=O.C56.N45
|
C[C@@]1(CCOCc2ccccc2)CCN1C(=O)CNC(=O)NC1CCCCC1
|
C[C@@]CCOCcccccc6))))))))))CCN4C=O)CNC=O)NCCCCCC6
|
[C][C@@][Branch1][=N][C][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1]
|
C[C@@]1%10CCN13.c1%11ccccc1.C19CCCCC1.C3(=O)C8.C%10C6.C45=O.O67.C7%11.N48.N59
|
CC[C@@H](C(=O)N[C@H]1CCC[C@H]1C(=O)NCCCCn1ccnc1)n1cncn1
|
CC[C@@H]C=O)N[C@H]CCC[C@H]5C=O)NCCCCnccnc5))))))))))))))))))ncncn5
|
[C][C][C@@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1][N][C][=N][C][=N][Ring1][Branch1]
|
CC[C@H]7C2=O.[C@H]15CCC[C@H]16.C4CCC8.n18ccnc1.n17cncn1.C36=O.N25.N34
|
C[C@H]1C[C@H](NC(=O)C2=COCC2)CN(C(=O)[C@@H](O)c2ccc(Cl)cc2F)C1
|
C[C@H]C[C@H]NC=O)C=COCC5)))))))CNC=O)[C@@H]O)ccccCl)cc6F)))))))))C6
|
[C][C@H1][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][O][C][C][Ring1][Branch1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][F][C][Ring2][Ring1][#Branch2]
|
C[C@H]1C[C@H]5CN4C1.c16ccc(Cl)cc1F.C3(=O)C1=COCC1.C4(=O)[C@H]6O.N35
|
O=C(CC=C(Cl)Cl)NCCOCC(=O)N[C@@H](CO)CN1CCCC1
|
O=CCC=CCl)Cl))))NCCOCC=O)N[C@@H]CO))CNCCCC5
|
[O][=C][Branch1][Branch2][C][C][=C][Branch1][C][Cl][Cl][N][C][C][O][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][N][C][C][C][C][Ring1][Branch1]
|
O=C2CC=C(Cl)Cl.[C@@H]7(C8)CO.N18CCCC1.C5C3=O.C6C4.N26.O45.N37
|
CSCCC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(-c2ccc(Cl)cc2)o1
|
CSCCC=O)NC[C@@H]C[C@H]5CN5C=O)cccc-ccccCl)cc6))))))o5
|
[C][S][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Ring1][Branch1][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][Ring1][N]
|
N13C[C@@H]2C[C@H]1CN24.c17ccc(Cl)cc1.c16ccc7o1.C5CC3=O.C46=O.CS5
|
COc1cccc(Cn2nc(C)nc2-c2nc3cnccc3s2)c1
|
COcccccCnncC)nc5-cnccnccc6s9)))))))))))))))c6
|
[C][O][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][N][N][=C][Branch1][C][C][N][=C][Ring1][=Branch1][C][=N][C][=C][N][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2][=C][Ring2][Ring1][=Branch1]
|
c17nc2cnccc2s1.c14cccc6c1.n15nc(C)nc17.CO4.C56
|
CC[C@@H]1CCCC[C@H]1C(=O)N1CC([C@H](C)NC(=O)C[C@H]2CCC(=O)N2C)C1
|
CC[C@@H]CCCC[C@H]6C=O)NCC[C@H]C)NC=O)C[C@H]CCC=O)N5C))))))))))C4
|
[C][C][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][=Branch1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][Ring1][P]
|
[C@@H]18CCCC[C@H]16.[C@H]17CCC(=O)N1C.N13CC9C1.C4(=O)C7.C36=O.[C@@H]59C.CC8.N45
|
CN(C(=O)c1ccc(F)o1)[C@H]1CCC[C@@H](NC(=O)COc2ccccc2)C1
|
CNC=O)ccccF)o5))))))[C@H]CCC[C@@H]NC=O)COcccccc6))))))))))C6
|
[C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][O][Ring1][=Branch1][C@H1][C][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P]
|
[C@H]17CCC[C@@H]8C1.c19ccc(F)o1.c16ccccc1.C4(=O)C5.CN37.C39=O.N48.O56
|
CN1CCC[C@@H]1C(=O)NC[C@H]1COC[C@H]1NC(=O)c1ccc(O)c(Cl)n1
|
CNCCC[C@@H]5C=O)NC[C@H]COC[C@H]5NC=O)ccccO)cCl)n6
|
[C][N][C][C][C][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][Branch1][C][Cl][=N][Ring1][Branch2]
|
c17ccc(O)c(Cl)n1.CN1CCC[C@@H]16.[C@H]18COC[C@H]15.C26=O.C37=O.N24.C48.N35
|
CC(C)n1ccc(CSCC(=O)Nc2ccc3ccccc3c2)n1
|
CCC)ncccCSCC=O)Nccccccccc6c%10)))))))))))))))n5
|
[C][C][Branch1][C][C][N][C][=C][C][Branch2][Ring1][#Branch1][C][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][=N][Ring2][Ring1][Branch1]
|
c17ccc2ccccc2c1.n18ccc9n1.C6C4=O.CC8C.C59.S56.N47
|
Cn1c(Cl)cnc1C(=O)N1C[C@@H]2C[C@H](NC(=O)C(F)(F)C(F)F)[C@@H]2C1
|
CncCl)cnc5C=O)NC[C@@H]C[C@H]NC=O)CF)F)CF)F)))))[C@@H]4C7
|
[C][N][C][Branch1][C][Cl][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F][C@@H1][Ring1][=N][C][Ring1][S]
|
N13C[C@@H]2C[C@H]5[C@@H]2C1.C4(=O)C(F)(F)C(F)F.Cn1c(Cl)cnc16.C36=O.N45
|
C[C@]1(CNC(=O)c2cc(Cl)no2)CCCN1C(=O)[C@H]1C[C@](C)(F)C1
|
C[C@]CNC=O)cccCl)no5))))))))CCCN5C=O)[C@H]C[C@]C)F)C4
|
[C][C@][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][O][Ring1][=Branch1][C][C][C][N][Ring1][#C][C][=Branch1][C][=O][C@H1][C][C@][Branch1][C][C][Branch1][C][F][C][Ring1][=Branch1]
|
C[C@]18CCCN14.c16cc(Cl)no1.[C@H]17C[C@](C)(F)C1.C36=O.C47=O.C58.N35
|
C[C@H](CC(=O)N1[C@@H]2C[C@@H](C[C@H]2O)[C@@H]1C(=O)N1CC(c2nncs2)C1)n1ccnc1
|
C[C@H]CC=O)N[C@@H]C[C@@H]C[C@H]5O)))[C@@H]5C=O)NCCcnncs5)))))C4))))))))))))nccnc5
|
[C][C@H1][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C@@H1][Branch1][=Branch1][C][C@H1][Ring1][Branch1][O][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][C][=N][N][=C][S][Ring1][Branch1][C][Ring1][=Branch2][N][C][=C][N][=C][Ring1][Branch1]
|
N13[C@@H]2C[C@@H](C[C@H]2O)[C@@H]15.C[C@@H]6CC3=O.N14CC7C1.c17nncs1.n16ccnc1.C45=O
|
CC1=C(C(=O)N(CC(=O)NC[C@@H](F)CO)CC(C)C)CCC1
|
CC=CC=O)NCC=O)NC[C@@H]F)CO)))))))CCC)C)))))CCC5
|
[C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][Branch1][=C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][F][C][O][C][C][Branch1][C][C][C][C][C][C][Ring2][Ring1][Branch1]
|
CC1=C(C2=O)CCC1.C5[C@@H](F)CO.C4C3=O.C6C(C)C.N246.N35
|
CCCC[C@H](NC(=O)C(C)=C1CC1)C(=O)NC[C@@H](C)[C@H](C)CC
|
CCCC[C@H]NC=O)CC)=CCC3))))))C=O)NC[C@@H]C)[C@H]C)CC
|
[C][C][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][Branch1][C][C][=C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C@H1][Branch1][C][C][C][C]
|
CCCC[C@H]4C3=O.C5[C@@H](C)[C@H](C)CC.C2(=O)C=6C.C1=6CC1.N24.N35
|
CC(C)[C@H](O)CC(=O)N1CC[C@@H](NC(=O)c2cccc([C@H]3CCOC3)c2)C1(C)C
|
CCC)[C@H]O)CC=O)NCC[C@@H]NC=O)ccccc[C@H]CCOC5)))))c6))))))))C5C)C
|
[C][C][Branch1][C][C][C@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][C@H1][C][C][O][C][Ring1][Branch1][=C][Ring1][O][C][Ring2][Ring1][Ring1][Branch1][C][C][C]
|
CC(C)[C@H](O)CC4=O.N14CC[C@@H]6C1(C)C.c17cccc8c1.[C@H]18CCOC1.C57=O.N56
|
C=C1C[C@@H](C(=O)Nc2ccc3nonc3c2)N(C(=O)c2cc(C)c(Br)cc2F)C1
|
C=CC[C@@H]C=O)Nccccnonc5c9)))))))))))NC=O)cccC)cBr)cc6F))))))))C5
|
[C][=C][C][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=N][O][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][Br][C][=C][Ring1][Branch2][F][C][Ring2][Ring1][N]
|
c16ccc2nonc2c1.c18cc(C)c(Br)cc1F.C=C1C[C@@H]7N5C1.C47=O.C58=O.N46
|
CC1(CCC(=O)N2CCN(C(=O)C[C@H]3CCCS(=O)(=O)C3)CC2)CC1
|
CCCCC=O)NCCNC=O)C[C@H]CCCS=O)=O)C6))))))))CC6)))))))))CC3
|
[C][C][Branch2][Ring2][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C@H1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][Branch2][C][C][Ring1][P][C][C][Ring2][Ring1][Branch2]
|
[C@H]17CCCS(=O)(=O)C1.N14CCN5CC1.C6CC4=O.CC16CC1.C5(=O)C7
|
O=C(c1cccc(F)c1I)N1CCO[C@@]2(CCCN(C(=O)[C@H]3[C@@H]4COC[C@@H]43)C2)C1
|
O=CcccccF)c6I)))))))NCCO[C@@]CCCNC=O)[C@H][C@@H]COC[C@@H]56)))))))C6)))))C6
|
[O][=C][Branch1][=N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][I][N][C][C][O][C@@][Branch2][Ring1][Branch2][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C@@H1][C][O][C][C@@H1][Ring1][Branch1][Ring1][=Branch1][C][Ring1][=C][C][Ring2][Ring1][Ring1]
|
N15CCO[C@@]2(CCCN6C2)C1.c18cccc(F)c1I.[C@@H]17[C@H]2COC[C@@H]12.O=C58.C67=O
|
CC[C@H](C)[C@H]1SC[C@@H](C(=O)O)N1C(=O)c1ccc(OCC(F)(F)F)cc1
|
CC[C@H]C)[C@H]SC[C@@H]C=O)O))N5C=O)ccccOCCF)F)F))))cc6
|
[C][C][C@H1][Branch1][C][C][C@H1][S][C][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][N]
|
[C@H]17SC[C@@H]5N12.c16ccc4cc1.C3C(F)(F)F.CC[C@@H]7C.C5(=O)O.C26=O.O34
|
O=C([C@H]1CN(Cc2cc(Cl)ccc2F)CCS1)N1CCCC[C@@H]1CO
|
O=C[C@H]CNCcccCl)ccc6F))))))))CCS6))))))NCCCC[C@@H]6CO
|
[O][=C][Branch2][Ring1][Branch2][C@H1][C][N][Branch1][=C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][F][C][C][S][Ring1][#C][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][O]
|
c17cc(Cl)ccc1F.[C@H]15CN4CCS1.N13CCCC[C@@H]16.O=C35.C47.C6O
|
O=C(NC12CC(CNC(=O)[C@@H]3CC4(CC4)CO3)(C1)C2)C1COC1
|
O=CNCCCCNC=O)[C@@H]CCCC3))CO5))))))))C4)C4)))))CCOC4
|
[O][=C][Branch2][Ring2][Ring1][N][C][C][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][O][Ring1][#Branch1][Branch1][Ring2][C][Ring1][#C][C][Ring1][S][C][C][O][C][Ring1][Ring2]
|
[C@@H]19CC2(CC2)CO1.C128CC%11(C1)C2.C1%10COC1.O=C5%10.C69=O.N58.C7%11.N67
|
Cc1cnc(CC(=O)N2CC[C@H](CNC(=O)[C@@H]3C[C@H]4C[C@H]3[C@H]3C[C@@H]43)C23CC3)s1
|
CccncCC=O)NCC[C@H]CNC=O)[C@@H]C[C@H]C[C@H]5[C@H]C[C@@H]63)))))))))))C5CC3)))))))))s5
|
[C][C][=C][N][=C][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][C][C@H1][Ring1][Branch1][C@H1][C][C@@H1][Ring1][=Branch1][Ring1][Ring1][C][Ring1][P][C][C][Ring1][Ring1][S][Ring2][Ring1][O]
|
N15CC[C@H]%10C12CC2.[C@@H]18C[C@H]2C[C@H]1[C@H]1C[C@@H]21.Cc1cnc9s1.C9C5=O.C68=O.C7%10.N67
|
COC(=O)[C@@H]1CC[C@@H](C(=O)N2C[C@]3(C(=O)N4CCC(O)CC4)C[C@H]2CO3)C1
|
COC=O)[C@@H]CC[C@@H]C=O)NC[C@]C=O)NCCCO)CC6)))))))C[C@H]5CO5))))))))C5
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C][C@@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@][Branch1][S][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][C][C@H1][Ring1][=C][C][O][Ring1][=C][C][Ring2][Ring1][#Branch1]
|
N16C[C@]28C[C@H]1CO2.N17CCC(O)CC1.[C@@H]19CC[C@@H]%10C1.C59=O.C6%10=O.C78=O.CO5
|
COn1cnc(C)c1C(=O)N[C@H]1CCCCN(C(=O)C=Cc2ccncc2)CC1
|
COncncC)c5C=O)N[C@H]CCCCNC=O)C=Ccccncc6)))))))))CC8
|
[C][O][N][C][=N][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][C]
|
[C@H]15CCCCN4CC1.COn1cnc(C)c16.C=7c1ccncc1.C4(=O)C=7.C36=O.N35
|
CC[C@H](C(=O)N1CCCC[C@@H](CNC(=O)c2c(N)sc3c2CCC3)C1)C(C)C
|
CC[C@H]C=O)NCCCC[C@@H]CNC=O)ccN)scc5CCC5)))))))))))C7))))))))CC)C
|
[C][C][C@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][N][S][C][=C][Ring1][=Branch1][C][C][C][Ring1][Branch1][C][Ring2][Ring1][Ring2][C][Branch1][C][C][C]
|
c17c(N)sc2c1CCC2.CC[C@H](C4=O)C(C)C.N14CCCC[C@@H]8C1.C57=O.C68.N56
|
C[C@@H](NC(=O)c1cc(O)no1)C1(O)CCN(C(=O)c2cnc(C#N)s2)CC1
|
C[C@@H]NC=O)cccO)no5)))))))CO)CCNC=O)ccncC#N))s5))))))CC6
|
[C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][O][Ring1][=Branch1][C][Branch1][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring1][C][#N][S][Ring1][#Branch1][C][C][Ring1][S]
|
C18(O)CCN4CC1.c17cnc(C#N)s1.c16cc(O)no1.C[C@@H]58.C36=O.C47=O.N35
|
C[C@@H]1C[C@]1(C#N)C(=O)N(C)CCN(C)C(=O)c1ccc(Br)c2c1OCCC2
|
C[C@@H]C[C@]3C#N))C=O)NC)CCNC)C=O)ccccBr)cc6OCCC6
|
[C][C@@H1][C][C@][Ring1][Ring1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][O][C][C][C][Ring1][=Branch1]
|
c18ccc(Br)c2c1OCCC2.C[C@@H]1C[C@@]17C#N.C37=O.N35C.C5C6.N46C.C48=O
|
COc1cc(C(=O)N[C@@H]2CC[C@H](NCc3scc(Br)c3Br)C2)nc2ccccc12
|
COcccC=O)N[C@@H]CC[C@H]NCcsccBr)c5Br))))))))C5)))))))ncccccc%106
|
[C][O][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][=C][N][C][C][S][C][=C][Branch1][C][Br][C][=Ring1][=Branch1][Br][C][Ring1][=C][=N][C][=C][C][=C][C][=C][Ring2][Ring1][O][Ring1][=Branch1]
|
c15cc9nc2ccccc12.c1%10scc(Br)c1Br.[C@@H]17CC[C@H]8C1.C49=O.CO5.N47.N68.C6%10
|
CCC(=Cc1ccccc1)C(=O)N1CCCC12CCC(NC(=O)CN(C)C)CC2
|
CCC=Ccccccc6)))))))C=O)NCCCC5CCCNC=O)CNC)C)))))CC6
|
[C][C][C][=Branch1][#Branch2][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][C][C][Branch1][N][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][C][Ring1][=N]
|
N13CCCC12CCC6CC2.C=7c1ccccc1.CCC=7C3=O.C4(=O)C5.N5(C)C.N46
|
C=C=C(C)CC(=O)N[C@H]1C[C@H]1NC(=O)[C@H](C)Cc1ccnn1C
|
C=C=CC)CC=O)N[C@H]C[C@H]3NC=O)[C@H]C)Ccccnn5C
|
[C][=C][=C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=C][C][=N][N][Ring1][Branch1][C]
|
C=C=C(C)CC2=O.C3(=O)[C@H](C)C6.c16ccnn1C.[C@H]14C[C@H]15.N24.N35
|
CCC(CC)(CNC(=O)c1conc1CNC(=O)c1c(C)cccc1C)C(N)=O
|
CCCCC))CNC=O)cconc5CNC=O)ccC)cccc6C))))))))))))))))))CN)=O
|
[C][C][C][Branch1][Ring1][C][C][Branch2][Ring1][S][C][N][C][=Branch1][C][=O][C][=C][O][N][=C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][C][Branch1][C][N][=O]
|
CCC(C4)(CC)C(N)=O.c17c(C)cccc1C.c16conc18.C26=O.C37=O.N24.C58.N35
|
OC[C@@H]1CN(c2nc3c(c(=N[C@@H]4CCSc5ccccc54)[nH]2)SCC3)CCO1
|
OC[C@@H]CNcnccc=N[C@@H]CCScccccc6%10)))))))))))[nH]6))SCC5)))))))CCO6
|
[O][C][C@@H1][C][N][Branch2][Ring2][Ring1][C][=N][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][S][=N][C@@H1][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][NH1][Ring1][P][S][C][C][Ring2][Ring1][C][C][C][O][Ring2][Ring1][#Branch2]
|
c16nc2c(c(=N[C@@H]3CCSc4ccccc43)[nH]1)SCC2.[C@@H]17CN6CCO1.OC7
|
CCOC(=O)C1CCN(C(=O)[C@H]2C[C@@H]2C(=O)Nc2ncc(I)nc2Cl)CC1
|
CCOC=O)CCCNC=O)[C@H]C[C@@H]3C=O)NcnccI)nc6Cl)))))))))))))CC6
|
[C][C][O][C][=Branch1][C][=O][C][C][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][I][N][=C][Ring1][#Branch1][Cl][C][C][Ring2][Ring1][=Branch1]
|
c17ncc(I)nc1Cl.C18CCN4CC1.[C@H]19C[C@@H]1%10.C38=O.C49=O.C5%10=O.CC6.O36.N57
|
CC[C@@H](CN(C)C(=O)C=C1CCCCC1(C)C)NC(=O)[C@]1(C)CCC(=O)N(C)C1
|
CC[C@@H]CNC)C=O)C=CCCCCC6C)C)))))))))))NC=O)[C@]C)CCC=O)NC)C6
|
[C][C][C@@H1][Branch2][Ring1][#Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][C][C][C][C][Ring1][=Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][=Branch2]
|
[C@@]16(C)CCC(=O)N(C)C1.C1=7CCCCC1(C)C.CC[C@H]4C5.C2(=O)C=7.N25C.C36=O.N34
|
C#CC[C@@H](O)C(=O)N(CCNC(=O)C1(NC(C)=O)CCC1)CCc1ccccc1
|
C#CC[C@@H]O)C=O)NCCNC=O)CNCC)=O)))CCC4))))))))CCcccccc6
|
[C][#C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][C][C][Ring1][Branch2][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C#CC[C@@H](O)C2=O.c1%10ccccc1.C179CCC1.N258.C5C6.C39=O.C4(C)=O.C8C%10.N36.N47
|
COC(=O)N(C)CC(=O)NC[C@@H]1C[C@@H](C)N(C(=O)C[C@@H]2CC[C@H](O)C2)C1
|
COC=O)NC)CC=O)NC[C@@H]C[C@@H]C)NC=O)C[C@@H]CC[C@H]O)C5)))))))C5
|
[C][O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C@@H1][C][C][C@H1][Branch1][C][O][C][Ring1][=Branch1][C][Ring1][#C]
|
[C@@H]19C[C@@H](C)N6C1.[C@@H]1%10CC[C@H](O)C1.C7C5=O.C6(=O)C%10.C34=O.N47C.CO3.N58.C89
|
CC1CN(C)CCN1C(=O)C1CCN(C2CCS(=O)(=O)C2)CC1
|
CCCNC)CCN6C=O)CCCNCCCS=O)=O)C5)))))CC6
|
[C][C][C][N][Branch1][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][N][Branch1][=C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1][C][C][Ring1][=N]
|
CC1CN(C)CCN13.C15CCN4CC1.C14CCS(=O)(=O)C1.C35=O
|
CC[C@@]1(C(=O)NOCC=C(C)C)CCCN1C(=O)C1=C(Cl)CCOC1
|
CC[C@@]C=O)NOCC=CC)C)))))))CCCN5C=O)C=CCl)CCOC6
|
[C][C][C@@][Branch1][=C][C][=Branch1][C][=O][N][O][C][C][=C][Branch1][C][C][C][C][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][C][O][C][Ring1][#Branch1]
|
C2(=O)C1=C(Cl)CCOC1.[C@@]146CCCN12.C4(=O)NO3.C3C=5.C=5(C)C.CC6
|
Cc1nsc(C)c1C(=O)N1C[C@@H]2[C@@H](CN(C)C(=O)c3cc(O)ncc3F)[C@@H]2C1
|
CcnscC)c5C=O)NC[C@@H][C@@H]CNC)C=O)cccO)ncc6F))))))))))[C@@H]3C6
|
[C][C][=N][S][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][C@@H1][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][=C][Ring1][#Branch1][F][C@@H1][Ring1][S][C][Ring2][Ring1][Ring1]
|
c18cc(O)ncc1F.Cc1nsc(C)c17.N14C[C@@H]2[C@@H]9[C@@H]2C1.C47=O.N56C.C58=O.C69
|
CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)c1cscn1
|
CCC)[C@H]NS=O)=O)ccccccccc6c%10))))))))))))C=O)NNC=O)ccscn5
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][N][C][=Branch1][C][=O][C][=C][S][C][=N][Ring1][Branch1]
|
S4(=O)(=O)c1ccc2ccccc2c1.CC(C)[C@H]3C(=O)NNC5=O.c15cscn1.N34
|
CCOc1cc(=NC(=O)[C@@]23C[C@H]2CN(Cc2ccc(C(=O)OC)cc2F)C3)[nH]o1
|
CCOccc=NC=O)[C@@]C[C@H]3CNCccccC=O)OC)))cc6F))))))))C6))))))))[nH]o5
|
[C][C][O][C][=C][C][=Branch2][Ring2][=Branch1][=N][C][=Branch1][C][=O][C@@][C][C@H1][Ring1][Ring1][C][N][Branch2][Ring1][Ring1][C][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][=C][Ring1][#Branch2][F][C][Ring2][Ring1][C][NH1][O][Ring2][Ring1][#Branch2]
|
c16cc(=NC8=O)[nH]o1.c1%10ccc9cc1F.[C@@]128C[C@H]1CN7C2.C49=O.CC5.O56.C7%10.O4C
|
C[C@@](O)(C(=O)N1CC2(CN(C(=O)c3cc[nH]c3C3CC3)C2)C1)C1CC1
|
C[C@@]O)C=O)NCCCNC=O)ccc[nH]c5CCC3)))))))))C4)))C4)))))CCC3
|
[C][C@@][Branch1][C][O][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][NH1][C][=Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring1][=C][C][Ring1][P][C][C][C][Ring1][Ring1]
|
N14CC2(C1)CN5C2.C[C@@]7(O)C4=O.c16cc[nH]c18.C56=O.C18CC1.C17CC1
|
Cc1cc(C(=O)N2CCN(C(=O)[C@@H]3CCCOC3)[C@H](CC3CC3)C2)sn1
|
CcccC=O)NCCNC=O)[C@@H]CCCOC6)))))))[C@H]CCCC3))))C6)))))))sn5
|
[C][C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][C][C][O][C][Ring1][=Branch1][C@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring2][Ring1][C][S][N][=Ring2][Ring1][=Branch2]
|
N14CCN5[C@H]8C1.Cc1cc6sn1.[C@@H]17CCCOC1.C46=O.C57=O.C19CC1.C89
|
COCC[C@H]1CN(C(=O)C2=COCCC2)CCN1C(=O)c1cc(SC)ccc1C
|
COCC[C@H]CNC=O)C=COCCC6)))))))CCN6C=O)cccSC))ccc6C
|
[C][O][C][C][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][O][C][C][C][Ring1][=Branch1][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][S][C][=C][C][=C][Ring1][Branch2][C]
|
[C@H]17CN3CCN14.C3(=O)C1=COCCC1.c16cc8ccc1C.C5C7.C46=O.CO5.S8C
|
CC[C@@H](O)C(=O)N1C[C@@H](CC(=O)NCCCN2CCOC2=O)C2(CC2)C1
|
CC[C@@H]O)C=O)NC[C@@H]CC=O)NCCCNCCOC5=O))))))))))))CCC3))C5
|
[C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][N][C][C][O][C][Ring1][Branch1][=O][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][Ring2]
|
N13C[C@@H]7C2(CC2)C1.CC[C@@H](O)C3=O.N16CCOC1=O.C7C4=O.C5CC6.N45
|
NC(=O)C(=O)NCC1(O)CC(NC(=O)[C@@]23CCC[C@H]2C3(F)F)C1
|
NC=O)C=O)NCCO)CCNC=O)[C@@]CCC[C@H]5C6F)F)))))))))C4
|
[N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@][C][C][C][C@H1][Ring1][Branch1][C][Ring1][=Branch1][Branch1][C][F][F][C][Ring1][S]
|
[C@@]128CCC[C@H]1C2(F)F.C19(O)CC7C1.NC(=O)C4=O.C58=O.N46.C69.N57
|
C[C@@H]1CCC[C@H](C(=O)NCCOCCCNC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)C1
|
C[C@@H]CCC[C@H]C=O)NCCOCCCNC=O)[C@H]CCC[C@@H]CF)F)F))C6))))))))))))))))C6
|
[C][C@@H1][C][C][C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][O][C][C][C][N][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][#Branch2][C][Ring2][Ring1][N]
|
C[C@@H]1CCC[C@H]9C1.[C@H]1%10CCC[C@@H]%11C1.C6CC8.C%11(F)(F)F.C39=O.C7C5.C4%10=O.N37.O56.N48
|
Cc1nc(C(C)C)ccc1C(=O)N[C@H](CNC(=O)C1(O)CCC1)C1CCCCC1
|
CcncCC)C))ccc6C=O)N[C@H]CNC=O)CO)CCC4)))))))CCCCCC6
|
[C][C][=N][C][Branch1][=Branch1][C][Branch1][C][C][C][=C][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][C][C][C][C][C][Ring1][=Branch1]
|
Cc1nc8ccc17.C19CCCCC1.C16(O)CCC1.[C@H]49C5.C8(C)C.C27=O.C36=O.N24.N35
|
C[C@@H](C(=O)NC[C@H]1CCCC[C@H]1C(=O)NCCC12CC(CO1)C2)S(N)(=O)=O
|
C[C@@H]C=O)NC[C@H]CCCC[C@H]6C=O)NCCCCCCO5))C4)))))))))))))))))SN)=O)=O
|
[C][C@@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][Branch1][C][O][Ring1][Branch1][C][Ring1][=Branch1][S][Branch1][C][N][=Branch1][C][=O][=O]
|
C[C@@H](C3=O)S(N)(=O)=O.[C@H]19CCCC[C@H]17.C128CC(CO1)C2.C47=O.C6C8.N35.C59.N46
|
CCCCSCC(=O)N1CC[C@@]2(CCCN2C(=O)[C@H]2Cc3cc(C)ccc3O2)C1
|
CCCCSCC=O)NCC[C@@]CCCN5C=O)[C@H]CcccC)ccc6O9))))))))))))))C5
|
[C][C][C][C][S][C][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][O][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][O][Ring1][#Branch2][C][Ring2][Ring1][Branch1]
|
N14CC[C@@]2(CCCN25)C1.[C@H]18Cc2cc(C)ccc2O1.CCCC6.C7C4=O.C58=O.S67
|
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H](C)N(C(=O)[C@@H]2COCCO2)C1
|
C[C@@H]CNC=O)C#CCC)C)C)))))C[C@H]C)NC=O)[C@@H]COCCO6)))))))C7
|
[C][C@@H1][C][N][Branch1][#C][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][Branch1][C][C][C][C][C@H1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@@H1][C][O][C][C][O][Ring1][=Branch1][C][Ring2][Ring1][Branch2]
|
C[C@@H]1CN3C[C@H](C)N4C1.C3(=O)C#CC(C)(C)C.[C@@H]15COCCO1.C45=O
|
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