SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CC(C)c1c(Cl)nc[nH]c1=NC[C@H]1[C@@H](C)CCCN1C(=O)C12CCCC1CCC2
|
CCC)ccCl)nc[nH]c6=NC[C@H][C@@H]C)CCCN6C=O)CCCCC5CCC8
|
[C][C][Branch1][C][C][C][=C][Branch1][C][Cl][N][=C][NH1][C][Ring1][#Branch1][=N][C][C@H1][C@@H1][Branch1][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][C][C][Ring1][Branch2]
|
c16c(Cl)nc[nH]c1=NC5.[C@H]15[C@@H](C)CCCN13.C124CCCC1CCC2.CC6C.C34=O
|
Cc1nnc(N[C@@H]2CC[C@H]3CN(C(=O)C=Cc4ccc(F)cc4)C[C@@H]32)nc1C
|
CcnncN[C@@H]CC[C@H]CNC=O)C=CccccF)cc6)))))))))C[C@@H]58)))))))))nc6C
|
[C][C][=N][N][=C][Branch2][Ring2][Ring1][N][C@@H1][C][C][C@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C@@H1][Ring1][S][Ring2][Ring1][Ring1][N][=C][Ring2][Ring1][#Branch2][C]
|
[C@@H]17CC[C@H]2CN5C[C@@H]21.Cc1nnc6nc1C.C=8c1ccc(F)cc1.C5(=O)C=8.N67
|
C=CC(C)(C)CC(=O)N1CC2(C[C@H](NC(=O)[C@H](CCC)NC(C)=O)CO2)C1
|
C=CCC)C)CC=O)NCCC[C@H]NC=O)[C@H]CCC)))NCC)=O))))))CO5))))C4
|
[C][=C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring2][C][C][C][N][C][Branch1][C][C][=O][C][O][Ring1][S][C][Ring2][Ring1][Ring1]
|
N13CC2(C[C@H]7CO2)C1.C=CC(C)(C)CC3=O.C4(=O)[C@@H]6CCC.C5(C)=O.N47.N56
|
Cc1c(Br)cncc1NC(=O)[C@@H]1CC(F)(F)CN1Cc1ccccc1Br
|
CccBr)cncc6NC=O)[C@@H]CCF)F)CN5Ccccccc6Br
|
[C][C][=C][Branch1][C][Br][C][=N][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][Branch1][C][F][Branch1][C][F][C][N][Ring1][#Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Br]
|
Cc1c4cncc1Br.[C@@H]15CC(F)(F)CN13.c16ccccc1Br.C25=O.N24.C36
|
CC[C@@H](O)C(C)(C)C(=O)N1CCC[C@@](O)(CNC(=O)CCNC(C)=O)C1
|
CC[C@@H]O)CC)C)C=O)NCCC[C@@]O)CNC=O)CCNCC)=O))))))))C6
|
[C][C][C@@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@][Branch1][C][O][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][N][C][Branch1][C][C][=O][C][Ring1][P]
|
CC[C@@H](O)C(C)(C)C2=O.N12CCC[C@]7(O)C1.C3(=O)CC6.C4(C)=O.C57.N35.N46
|
C[C@]1(C(=O)N2CCC(=CC(=O)Nc3cccnc3Cl)CC2)CCCN1
|
C[C@]C=O)NCCC=CC=O)Nccccnc6Cl))))))))))CC6)))))))CCCN5
|
[C][C@][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][=Branch1][S][=C][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Ring1][=Branch1][Cl][C][C][Ring1][P][C][C][C][N][Ring2][Ring1][Branch2]
|
N14CCC=8CC1.c16cccnc1Cl.C[C@]17CCCN1.C=8C5=O.C47=O.N56
|
CCO[C@@H](C(=O)N(C)CCCN(C)C(=O)c1c[nH]c2ccncc12)[C@H]1CCOC1
|
CCO[C@@H]C=O)NC)CCCNC)C=O)cc[nH]cccncc96))))))))))))))))[C@H]CCOC5
|
[C][C][O][C@@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][=N][C][=C][Ring1][=Branch2][Ring1][=Branch1][C@H1][C][C][O][C][Ring1][Branch1]
|
c19c[nH]c2ccncc12.[C@@H]6%10C3=O.[C@H]1%10CCOC1.C7CC8.N37C.N48C.C49=O.CC5.O56
|
CCC(CC)[C@H](F)C(=O)NC1(C(=O)N(C)CCc2ccccn2)CC(F)C1
|
CCCCC))[C@H]F)C=O)NCC=O)NC)CCcccccn6))))))))))CCF)C4
|
[C][C][C][Branch1][Ring1][C][C][C@H1][Branch1][C][F][C][=Branch1][C][=O][N][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][Branch1][C][F][C][Ring1][P]
|
CCC(CC)[C@H](F)C3=O.C157CC(F)C1.c18ccccn1.C47=O.N46C.C6C8.N35
|
Cc1nccc(C(=O)N2CCCC[C@H]2CNC(=O)C2(C)C[C@H]3CC[C@@H](C2)S3)c1N
|
CcncccC=O)NCCCC[C@H]6CNC=O)CC)C[C@H]CC[C@@H]C7)S5)))))))))))))))))c6N
|
[C][C][=N][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch2][S][Ring1][=Branch1][=C][Ring2][Ring1][O][N]
|
C17(C)C[C@H]2CC[C@@H](C1)S2.Cc1nccc8c1N.N14CCCC[C@H]19.C48=O.C57=O.C69.N56
|
O=C(COc1ccc(F)cn1)N[C@@]12CN(C(=O)c3ccc[nH]3)C[C@H]1CS(=O)(=O)C2
|
O=CCOccccF)cn6))))))))N[C@@]CNC=O)cccc[nH]5))))))C[C@H]5CS=O)=O)C8
|
[O][=C][Branch1][=C][C][O][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][N][C@@][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][Ring1][Branch1][C][C@H1][Ring1][N][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][P]
|
[C@@]128CN5C[C@H]1CS(=O)(=O)C2.c17ccc(F)cn1.c19ccc[nH]1.O=C4C6.C59=O.O67.N48
|
O=C(NCC[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1)C1CC(C(F)F)C1
|
O=CNCC[C@H]CCCCN6C=O)cccc[N+]=O)[O-]))cc6))))))))))))))))CCCCF)F))C4
|
[O][=C][Branch2][Ring1][#C][N][C][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C][C][Branch1][=Branch1][C][Branch1][C][F][F][C][Ring1][#Branch1]
|
c16ccc([N+](=O)[O-])cc1.[C@H]17CCCCN13.C15CC8C1.O=C25.C4C7.C36=O.C8(F)F.N24
|
Cc1c(CNC(=O)OC(C)(C)C)c(=NC(=O)[C@H]2CC23CCC3)[nH]n1C
|
CccCNC=O)OCC)C)C))))))c=NC=O)[C@H]CC3CCC4))))))))[nH]n5C
|
[C][C][=C][Branch1][S][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][S][=N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][C][Ring1][Ring2][NH1][N][Ring2][Ring1][#Branch1][C]
|
Cc1c9c(=NC8=O)[nH]n1C.[C@H]18CC12CCC2.C6(C)(C)C.C45=O.C79.N57.O46
|
C[C@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@@H]1C(=O)NCC1CCC(C)(C)CC1
|
C[C@H]CCNC=O)cccO)nC)n5))))))[C@@H]5C=O)NCCCCCC)C)CC6
|
[C][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][Branch1][C][O][N][Branch1][C][C][N][=Ring1][#Branch1][C@@H1][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2]
|
C18CCC(C)(C)CC1.C[C@H]1CCN3[C@@H]16.c17cc(O)n(C)n1.C37=O.C46=O.N45.C58
|
CC(C)COc1ccc(Cl)cc1C(=O)NCCOCCNC(=O)C1(CF)COC1
|
CCC)COccccCl)cc6C=O)NCCOCCNC=O)CCF))COC4
|
[C][C][Branch1][C][C][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][O][C][C][N][C][=Branch1][C][=O][C][Branch1][Ring1][C][F][C][O][C][Ring1][=Branch1]
|
c19ccc(Cl)cc13.C1%124COC1.CC(C)C6.C23=O.C%10C7.C8C%11.C5%12=O.O69.N2%10.O78.N5%11.C4F
|
COC(=O)c1cc(I)c(Cl)cc1NC(=O)C1CCC(NC(=O)COC(C)=O)CC1
|
COC=O)cccI)cCl)cc6NC=O)CCCCNC=O)COCC)=O))))))CC6
|
[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][I][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][C][C][Branch1][=N][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][=O][C][C][Ring1][=C]
|
c1%10cc(I)c(Cl)cc17.C19CCC8CC1.C5(=O)C6.C2%10=O.C49=O.C3(C)=O.CO2.N47.N58.O36
|
Cc1scnc1C(=O)NCc1cc(C(=O)NCc2cnccn2)n[nH]1
|
Ccscnc5C=O)NCcccC=O)NCccnccn6)))))))))n[nH]5
|
[C][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][#C][C][=Branch1][C][=O][N][C][C][=C][N][=C][C][=N][Ring1][=Branch1][=N][NH1][Ring1][#C]
|
Cc1scnc17.c19cc8n[nH]1.c1%10cnccn1.C37=O.C48=O.N35.C59.N46.C6%10
|
Cc1cccc(F)c1S(=O)(=O)N1CC2(CC(C(=O)O)CO2)C1
|
CcccccF)c6S=O)=O)NCCCCC=O)O))CO5))))C4
|
[C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch1][=C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][O][Ring1][Branch2][C][Ring1][O]
|
Cc1cccc(F)c1S3(=O)=O.N13CC2(CC4CO2)C1.C4(=O)O
|
C#CCN(CCC(=O)N1CCc2nn[nH]c2C1)C(=O)c1ccc(SC)o1
|
C#CCNCCC=O)NCCcnn[nH]c5C9))))))))))))C=O)ccccSC))o5
|
[C][#C][C][N][Branch2][Ring1][Ring2][C][C][C][=Branch1][C][=O][N][C][C][C][N][=N][NH1][C][=Ring1][Branch1][C][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][S][C][O][Ring1][#Branch1]
|
N13CCc2nn[nH]c2C1.c17ccc8o1.C6CC3=O.C#CC5.N456.C47=O.S8C
|
CN(C(=O)c1cc(Cl)ns1)[C@@H](CC(F)F)C(=O)N[C@H](CO)c1ncc[nH]1
|
CNC=O)cccCl)ns5))))))[C@@H]CCF)F)))C=O)N[C@H]CO))cncc[nH]5
|
[C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][S][Ring1][=Branch1][C@@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][=N][C][=C][NH1][Ring1][Branch1]
|
[C@H]4(CC(F)F)C3=O.c16cc(Cl)ns1.c17ncc[nH]1.[C@H]57CO.CN24.C26=O.N35
|
C#CC[C@H](NC(=O)[C@@H](C)C1CCN(C(=O)[C@H]2C3C[C@@H]4C2[C@@H]4C3)CC1)C(=O)NC
|
C#CC[C@H]NC=O)[C@@H]C)CCCNC=O)[C@H]CC[C@@H]C5[C@@H]3C6))))))))CC6)))))))))C=O)NC
|
[C][#C][C][C@H1][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C][C@@H1][C][Ring1][Branch1][C@@H1][Ring1][Ring1][C][Ring1][=Branch1][C][C][Ring1][#C][C][=Branch1][C][=O][N][C]
|
C#CC[C@H]8C7=O.C1%10CCN6CC1.[C@H]19C2C[C@@H]3C1[C@@H]3C2.C5(=O)[C@H]%10C.C69=O.N58.N7C
|
CCCCc1ocnc1C(=O)NC[C@@]1(O)CCN(C(=O)[C@@]23CC[C@@H](O)[C@@H]2CC3)C1
|
CCCCcocnc5C=O)NC[C@@]O)CCNC=O)[C@@]CC[C@@H]O)[C@@H]5CC7))))))))C5
|
[C][C][C][C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][O][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@][C][C][C@@H1][Branch1][C][O][C@@H1][Ring1][=Branch1][C][C][Ring1][Branch2][C][Ring1][S]
|
[C@@]128CC[C@@H](O)[C@@H]1CC2.[C@]1%10(O)CCN5C1.c19ocnc17.CCCC9.C47=O.C58=O.N46.C6%10
|
CCOc1ccc(-c2cccc(CC(=O)N3CCN(C4CCCC4)CC3)n2)cn1
|
CCOcccc-cccccCC=O)NCCNCCCCC5)))))CC6))))))))n6))))))cn6
|
[C][C][O][C][=C][C][=C][Branch2][Ring2][Ring1][C][=C][C][=C][C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][O][=N][Ring2][Ring1][Ring2][C][=N][Ring2][Ring1][#Branch2]
|
c17ccc%10cn1.c1%10cccc9n1.N15CCN8CC1.C18CCCC1.C9C5=O.CC6.O67
|
C[C@@H](CC(=O)N1CC=C(CNC(=O)[C@H]2CC2(F)F)CC1)Cc1ccc(Cl)cc1
|
C[C@@H]CC=O)NCC=CCNC=O)[C@H]CC3F)F)))))))CC6))))))))CccccCl)cc6
|
[C][C@@H1][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][C][=C][Branch1][S][C][N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][Branch1][C][F][F][C][C][Ring1][#C][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
|
N13CC=C(C5)CC1.C[C@H](C7)CC3=O.c17ccc(Cl)cc1.[C@H]16CC1(F)F.C46=O.N45
|
C[C@H]1CN(C(=O)c2c(O)cccc2F)CCN1C(=O)c1ccc(CO)c(Cl)c1
|
C[C@H]CNC=O)ccO)cccc6F))))))))CCN6C=O)ccccCO))cCl)c6
|
[C][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][F][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][O][C][Branch1][C][Cl][=C][Ring1][=Branch2]
|
C[C@H]1CN3CCN14.c15c(O)cccc1F.c16ccc7c(Cl)c1.C35=O.C46=O.C7O
|
CC[C@H](CNC(=O)c1cc(Cl)ccn1)N=c1ncc2ccccc2[nH]1
|
CC[C@H]CNC=O)cccCl)ccn6)))))))))N=cnccccccc6[nH]%10
|
[C][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][=N][Ring1][#Branch1][N][=C][N][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][#Branch2]
|
CC[C@H](C4)N=c1ncc2ccccc2[nH]1.c15cc(Cl)ccn1.C35=O.N34
|
C[C@@H]1CCCN(C(=O)[C@H](C)C2CC2)[C@@H]1CNC(=O)[C@@H]1COC(=O)N1C
|
C[C@@H]CCCNC=O)[C@H]C)CCC3)))))[C@@H]6CNC=O)[C@@H]COC=O)N5C
|
[C][C@@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][C@@H1][Ring1][=N][C][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C]
|
C[C@@H]1CCCN3[C@@H]17.[C@@H]16COC(=O)N1C.C3(=O)[C@@H]8C.C18CC1.C46=O.C57.N45
|
CO[C@H]1C[C@@H](NC(=O)C2CCC=CCC2)CN(C(=O)CCOC[C@@H]2CCCO2)C1
|
CO[C@H]C[C@@H]NC=O)CCCC=CCC7)))))))))CNC=O)CCOC[C@@H]CCCO5))))))))))C6
|
[C][O][C@H1][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][C][=C][C][C][Ring1][#Branch1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][O][C][C@@H1][C][C][C][O][Ring1][Branch1][C][Ring2][Ring1][O]
|
[C@H]17C[C@@H]8CN4C1.C19CCC=CCC1.C4(=O)CC5.[C@@H]1%10CCCO1.C39=O.CO7.N38.O56.C6%10
|
Cc1c(C(=O)NC[C@H](NC(=O)Cc2ccoc2)[C@@H]2CCOC2)nn(C)c1Br
|
CccC=O)NC[C@H]NC=O)Ccccoc5))))))))[C@@H]CCOC5)))))))))nnC)c5Br
|
[C][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][=C][O][C][=Ring1][Branch1][C@@H1][C][C][O][C][Ring1][Branch1][=N][N][Branch1][C][C][C][=Ring2][Ring1][=Branch2][Br]
|
Cc1c7nn(C)c1Br.c19ccoc1.[C@@H]18CCOC1.C5[C@H]68.C4(=O)C9.C37=O.N35.N46
|
Cc1ccc(S(=O)(=O)CCC(=O)N2CCN(C(=O)C3=COCCO3)[C@@H](C)C2)cc1
|
CccccS=O)=O)CCC=O)NCCNC=O)C=COCCO6)))))))[C@@H]C)C6))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring2][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][O][C][C][O][Ring1][=Branch1][C@@H1][Branch1][C][C][C][Ring1][#C][C][=C][Ring2][Ring1][N]
|
Cc1ccc(S(=O)(=O)CCC4=O)cc1.N14CCN5[C@@H](C)C1.C5(=O)C1=COCCO1
|
O=C(NCC(C1CCC1)C1CCC1)NC[C@@H]1CNC(=O)O1
|
O=CNCCCCCC4))))CCCC4)))))))NC[C@@H]CNC=O)O5
|
[O][=C][Branch2][Ring1][C][N][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][C][C][C][Ring1][Ring2][N][C][C@@H1][C][N][C][=Branch1][C][=O][O][Ring1][=Branch1]
|
[C@@H]16CNC(=O)O1.C4C78.C17CCC1.C18CCC1.O=C23.N24.N35.C56
|
CO[C@@H](CNC(=O)c1oc(C)nc1C)C(=O)N[C@](C)(CO)C1CCC1
|
CO[C@@H]CNC=O)cocC)nc5C)))))))))C=O)N[C@]C)CO))CCCC4
|
[C][O][C@@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][=N][C][=Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@][Branch1][C][C][Branch1][Ring1][C][O][C][C][C][C][Ring1][Ring2]
|
c17oc(C)nc1C.[C@H]4(C5)C3=O.[C@]68(C)CO.C18CCC1.C27=O.CO4.N25.N36
|
CC(C)[C@@H](C(=O)N(C)[C@H](CNC(=O)/C=C/c1nnn(C)n1)C1CC1)n1cncn1
|
CCC)[C@@H]C=O)NC)[C@H]CNC=O)/C=C/cnnnC)n5))))))))))CCC3))))))ncncn5
|
[C][C][Branch1][C][C][C@@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][/C][=C][/C][N][=N][N][Branch1][C][C][N][=Ring1][=Branch1][C][C][C][Ring1][Ring1][N][C][=N][C][=N][Ring1][Branch1]
|
CC(C)[C@H]7C2=O.C=6c1nnn(C)n1.n17cncn1.[C@H]48C5.C3(=O)C=6.N24C.C18CC1.N35
|
CO[C@H](C)C(=O)N1CCCC[C@@H]1CCC(C)(C)NC(=O)Cn1ncccc1=O
|
CO[C@H]C)C=O)NCCCC[C@@H]6CCCC)C)NC=O)Cnncccc6=O
|
[C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][N][N][=C][C][=C][C][Ring1][=Branch1][=O]
|
N12CCCC[C@@H]17.n16ncccc1=O.C7CC5(C)C.[C@@H]4(C)C2=O.C3(=O)C6.CO4.N35
|
CCc1ncc(C(=O)N[C@@H]2CCN(C(=O)CCOCC(F)F)[C@H](C)C2)o1
|
CCcnccC=O)N[C@@H]CCNC=O)CCOCCF)F)))))))[C@H]C)C6))))))))o5
|
[C][C][C][=N][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][O][C][C][Branch1][C][F][F][C@H1][Branch1][C][C][C][Ring1][S][O][Ring2][Ring1][Branch2]
|
[C@@H]17CCN4[C@H](C)C1.c19ncc8o1.C4(=O)CC5.C6C(F)F.C38=O.CC9.N37.O56
|
CC(C)c1nc(C(=O)N2C[C@H](C)[C@H](NC(=O)CSC[C@@H]3CCCO3)C2)cs1
|
CCC)cncC=O)NC[C@H]C)[C@H]NC=O)CSC[C@@H]CCCO5))))))))))C5))))))cs5
|
[C][C][Branch1][C][C][C][=N][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][S][C][C@@H1][C][C][C][O][Ring1][Branch1][C][Ring1][P][=C][S][Ring2][Ring1][Branch2]
|
N14C[C@@H]8[C@@H](C)C1.c1%11nc9cs1.[C@@H]1%10CCCO1.C5(=O)C6.CC%11C.C49=O.N58.S67.C7%10
|
C/C=C/CCCN=c1cc(C)c(S(=O)(=O)NC[C@@]2(C)CCCOC2)c[nH]1
|
C/C=C/CCCN=cccC)cS=O)=O)NC[C@@]C)CCCOC6)))))))))c[nH]6
|
[C][/C][=C][/C][C][C][N][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C@@][Branch1][C][C][C][C][C][O][C][Ring1][#Branch1][=C][NH1][Ring2][Ring1][Ring1]
|
C=5CCCN=c1cc(C)c(S4(=O)=O)c[nH]1.[C@]16(C)CCCOC1.CC=5.N34.C36
|
C[C@H](OC(C)(C)C)C(=O)N1CC2(CN(C(=O)COC(F)(F)C(F)(F)F)CCO2)C1
|
C[C@H]OCC)C)C)))C=O)NCCCNC=O)COCF)F)CF)F)F))))))CCO6)))))C4
|
[C][C@H1][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][S][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][O][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][C][O][Ring1][P][C][Ring2][Ring1][Ring2]
|
N13CC2(C1)CN4CCO2.C8(F)(F)C(F)(F)F.C[C@H]5C3=O.C6(C)(C)C.C4(=O)C7.O56.O78
|
CC1(C)C[C@H](NC(=O)[C@@]2(C)CCCOC2)CCN(C(=O)CCCC(F)(F)F)C1
|
CCC)C[C@H]NC=O)[C@@]C)CCCOC6))))))))CCNC=O)CCCCF)F)F))))))C7
|
[C][C][Branch1][C][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C][O][C][Ring1][#Branch1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][O]
|
CC1(C)C[C@H]5CCN4C1.C4(=O)CCCC(F)(F)F.[C@]16(C)CCCOC1.C36=O.N35
|
CCO[C@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2CCCCN2CCCC2)C1
|
CCO[C@H]CCCNcnnc[C@@H]CCCCO6))))))n5CCCCNCCCC5))))))))))))))C6
|
[C][C][O][C@H1][C][C][C][N][Branch2][Ring1][=N][C][=N][N][=C][Branch1][=Branch2][C@@H1][C][C][C][C][O][Ring1][=Branch1][N][Ring1][O][C][C][C][C][N][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][#Branch2]
|
[C@H]15CCCN7C1.c17nnc9n18.[C@@H]19CCCCO1.C8CCC6.N16CCCC1.CC4.O45
|
Cc1c(C(=O)N(CCNC(=O)c2ccc(Br)c(O)n2)C(C)C)ccn1C1CC1
|
CccC=O)NCCNC=O)ccccBr)cO)n6))))))))))CC)C))))ccn5CCC3
|
[C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][O][=N][Ring1][Branch2][C][Branch1][C][C][C][C][=C][N][Ring2][Ring1][Branch2][C][C][C][Ring1][Ring1]
|
c18ccc(Br)c(O)n1.Cc1c9ccn1%10.C39=O.N357.C5C6.C48=O.C7(C)C.C1%10CC1.N46
|
Cc1cn(C)nc1C(=O)NC1[C@H]2C[C@H]1CN(C(=O)[C@H]1CCC(C)(C)O1)C2
|
CccnC)nc5C=O)NC[C@H]C[C@H]4CNC=O)[C@H]CCCC)C)O5))))))C6
|
[C][C][=C][N][Branch1][C][C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Ring1][Ring2][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][#Branch1][C][Ring1][#C]
|
C15[C@H]2C[C@H]1CN4C2.Cc1cn(C)nc17.[C@H]16CCC(C)(C)O1.C37=O.C46=O.N35
|
CC(C)(C)OCC(=O)N1C[C@H]2COCC[C@@]2(NC(=O)c2cc(C(F)F)cs2)C1
|
CCC)C)OCC=O)NC[C@H]COCC[C@@]6NC=O)cccCF)F))cs5)))))))C9
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C][C@@][Ring1][=Branch1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=C][S][Ring1][Branch2][C][Ring2][Ring1][Ring2]
|
N13C[C@H]2COCC[C@@]27C1.c18cc9cs1.CC5(C)C.C6C3=O.C48=O.C9(F)F.O56.N47
|
CN(CCCCNC(=O)c1nc(C(F)(F)F)oc1Br)C(=O)C1=CCCC1
|
CNCCCCNC=O)cncCF)F)F))oc5Br))))))))))))C=O)C=CCCC5
|
[C][N][Branch2][Ring1][N][C][C][C][C][N][C][=Branch1][C][=O][C][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][O][C][=Ring1][=Branch2][Br][C][=Branch1][C][=O][C][=C][C][C][C][Ring1][Branch1]
|
c16nc7oc1Br.C3(=O)C1=CCCC1.C4CCC5.C7(F)(F)F.CN34.C26=O.N25
|
CO[C@H](C)C(=O)NC[C@H]1CCC[C@@H]1NC(=O)[C@@H](C)C1CCCCCC1
|
CO[C@H]C)C=O)NC[C@H]CCC[C@@H]5NC=O)[C@@H]C)CCCCCCC7
|
[C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][C][C][C][C][C][Ring1][#Branch1]
|
C18CCCCCC1.[C@H]17CCC[C@@H]16.[C@@H]4(C)C2=O.C3(=O)[C@H]8C.CO4.N25.C57.N36
|
CSC1(C(=O)NC[C@@H]2CC(=O)N[C@@H](C)C2)CN(C(=O)[C@@H]2C=CCS2)C1
|
CSCC=O)NC[C@@H]CC=O)N[C@@H]C)C6)))))))))CNC=O)[C@@H]C=CCS5))))))C4
|
[C][S][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][Ring1][Branch2][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][=C][C][S][Ring1][Branch1][C][Ring2][Ring1][#Branch1]
|
[C@@H]19CC(=O)N[C@@H](C)C1.C168CN4C1.[C@@H]17C=CCS1.C38=O.C47=O.CS6.N35.C59
|
CC(C)/C=C/C(=O)N1CC[C@@]2(CCOC2)[C@@H](CNC(=O)CCCC(N)=O)C1
|
CCC)/C=C/C=O)NCC[C@@]CCOC5))))[C@@H]CNC=O)CCCCN)=O))))))))C6
|
[C][C][Branch1][C][C][/C][=C][/C][=Branch1][C][=O][N][C][C][C@@][Branch1][#Branch1][C][C][O][C][Ring1][Branch1][C@@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][N][=O][C][Ring2][Ring1][Ring2]
|
N13CC[C@@]2(CCOC2)[C@@H]7C1.C4(=O)CCCC(N)=O.CC(C)C=6.C=6C3=O.C57.N45
|
CCn1nnnc1[C@H](N[C@H]1CCc2c1ccc(OC)c2OC)c1c(C)ncn1C
|
CCnnnnc5[C@H]N[C@H]CCcc5cccOC))c6OC))))))))))))ccC)ncn5C
|
[C][C][N][N][=N][N][=C][Ring1][Branch1][C@H1][Branch2][Ring1][Branch1][N][C@H1][C][C][C][=C][Ring1][Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][O][C][C][=C][Branch1][C][C][N][=C][N][Ring1][=Branch1][C]
|
N5[C@H]1CCc2c1ccc3c24.c18c(C)ncn1C.n16nnnc17.[C@H]578.CC6.O3C.O4C
|
COCCCn1cc(C(=O)NCC2(Nc3cc(=O)n(C)c(O)n3)CCCC2)cn1
|
COCCCnccC=O)NCCNccc=O)nC)cO)n6)))))))CCCC5))))))))cn5
|
[C][O][C][C][C][N][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][N][C][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][Branch1][C][O][=N][Ring1][=Branch2][C][C][C][C][Ring1][#C][C][=N][Ring2][Ring1][Branch2]
|
c18cc(=O)n(C)c(O)n1.n1%10cc9cn1.C17%11CCCC1.C5CC%10.C49=O.CO5.N46.C6%11.N78
|
Nc1c(F)cc(F)cc1C(=O)N1CC[C@@]2(CCCN2C(=O)CCc2cnco2)C1
|
NccF)ccF)cc6C=O)NCC[C@@]CCCN5C=O)CCccnco5))))))))))))C5
|
[N][C][=C][Branch1][C][F][C][=C][Branch1][C][F][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C@@][Branch2][Ring1][Ring2][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][=C][N][=C][O][Ring1][Branch1][C][Ring2][Ring1][C]
|
N13CC[C@@]2(CCCN24)C1.Nc1c5cc(F)cc1F.C4(=O)CC6.c16cnco1.C35=O
|
CC(C)(C(=O)NC[C@H](O)CCNC(=O)c1ccc2nc[nH]c2c1)c1cnsc1
|
CCC)C=O)NC[C@H]O)CCNC=O)ccccnc[nH]c5c9)))))))))))))))))ccnsc5
|
[C][C][Branch1][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C][=N][S][C][=Ring1][Branch1]
|
c17ccc2nc[nH]c2c1.CC8(C)C3=O.C5[C@H](O)CC6.c18cnsc1.C47=O.N35.N46
|
COC[C@@](C)(O)CC(=O)N1CCN(C(=O)COCCSC)[C@@H](C)C1
|
COC[C@@]C)O)CC=O)NCCNC=O)COCCSC)))))))[C@@H]C)C6
|
[C][O][C][C@@][Branch1][C][C][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][N][Branch1][O][C][=Branch1][C][=O][C][O][C][C][S][C][C@@H1][Branch1][C][C][C][Ring1][#C]
|
C4[C@@](C)(O)CC2=O.N12CCN3[C@@H](C)C1.C3(=O)C5.C6C7.CO4.O56.S7C
|
Cn1cnc2c(C(=O)N[C@]34CCCN(C(=O)c5coc(Br)n5)C[C@H]3C4)ccnc21
|
CncnccC=O)N[C@]CCCNC=O)ccocBr)n5))))))C[C@H]7C8))))))))))ccnc69
|
[C][N][C][=N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][O][C][Branch1][C][Br][=N][Ring1][=Branch1][C][C@H1][Ring1][#C][C][Ring1][S][C][=C][N][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][N]
|
Cn1cnc2c%10ccnc21.[C@]128CCCN7C[C@H]1C2.c19coc(Br)n1.C6%10=O.C79=O.N68
|
COc1cc(OC)c(Cc2noc(-c3ncnc4sccc34)n2)cn1
|
COcccOC))cCcnoc-cncncsccc95)))))))))n5))))))cn6
|
[C][O][C][=C][C][Branch1][Ring1][O][C][=C][Branch2][Ring1][Branch2][C][C][=N][O][C][Branch1][=C][C][=N][C][=N][C][S][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][=N][Ring1][=C][C][=N][Ring2][Ring1][#Branch1]
|
c19ncnc2sccc12.c15cc6c8cn1.c17noc9n1.CO5.O6C.C78
|
CCc1cc(C(=O)N2C[C@](C)(C(=O)NC3(CF)CCCC3)CC2(C)C)no1
|
CCcccC=O)NC[C@]C)C=O)NCCF))CCCC5)))))))CC5C)C)))))))no5
|
[C][C][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][P][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][F][C][C][C][C][Ring1][#Branch1][C][C][Ring1][S][Branch1][C][C][C][=N][O][Ring2][Ring1][=Branch2]
|
N14C[C@@]8(C)CC1(C)C.c19cc7no1.C16%10CCCC1.C47=O.C58=O.CC9.N56.C%10F
|
C=CCNC(=O)CNC(=O)Cn1cc(CNC(=O)C(=O)C(C)C)nn1
|
C=CCNC=O)CNC=O)CnccCNC=O)C=O)CC)C))))))nn5
|
[C][=C][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][N][C][=C][Branch1][S][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][Branch1][C][C][C][N][=N][Ring1][=C]
|
C4(=O)C(=O)C(C)C.n18cc9nn1.C2(=O)C6.C3(=O)C8.C=CC5.N25.N36.C79.N47
|
CCCCC/C=C/CC(=O)NC(C)(C)CCCNC(=O)CC(C)(F)F
|
CCCCC/C=C/CC=O)NCC)C)CCCNC=O)CCC)F)F
|
[C][C][C][C][C][/C][=C][/C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][F][F]
|
C3(C)(C)CCC4.C2(=O)CC(C)(F)F.CCCCCC=5.C=5CC1=O.N13.N24
|
CC[C@H](O)CC(=O)N1CC[C@H]([C@@H](C)NC(=O)C(F)(F)C2CC2)C1
|
CC[C@H]O)CC=O)NCC[C@H][C@@H]C)NC=O)CF)F)CCC3)))))))C5
|
[C][C][C@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][=Branch1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][C][C][Ring1][Ring1][C][Ring1][S]
|
CC[C@H](O)CC3=O.N13CC[C@H]6C1.C4(=O)C7(F)F.[C@H]56C.C17CC1.N45
|
O=C(OCc1ccno1)c1cc(-c2ccc(Br)cc2)no1
|
O=COCcccno5)))))))ccc-ccccBr)cc6))))))no5
|
[O][=C][Branch1][#Branch2][O][C][C][=C][C][=N][O][Ring1][Branch1][C][=C][C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][=N][O][Ring1][N]
|
c17ccc(Br)cc1.c15cc7no1.c16ccno1.O=C35.O34.C46
|
Cn1cnc(C=CC(=O)N2CCC(F)(CNC(=O)c3sccc3C(F)F)CC2)c1
|
CncncC=CC=O)NCCCF)CNC=O)csccc5CF)F))))))))))CC6)))))))))c5
|
[C][N][C][=N][C][Branch2][Ring2][Branch2][C][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][C][Branch1][C][F][F][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][N]
|
N14CCC9(F)CC1.Cn1cnc(C=8)c1.c17sccc1%10.C=8C4=O.C57=O.C%10(F)F.C69.N56
|
Cc1cccc(C[C@@H](C)N=c2[nH]c(=NC[C@H]3COCCO3)[nH]c3c2CSC3)c1
|
CcccccC[C@@H]C)N=c[nH]c=NC[C@H]COCCO6))))))))[nH]cc6CSC5))))))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring1][S][C][C@@H1][Branch1][C][C][N][=C][NH1][C][=Branch1][O][=N][C][C@H1][C][O][C][C][O][Ring1][=Branch1][NH1][C][=C][Ring1][=C][C][S][C][Ring1][Branch1][=C][Ring2][Ring1][O]
|
C5[C@@H](C)N=c1[nH]c(=NC4)[nH]c2c1CSC2.Cc1cccc5c1.[C@H]14COCCO1
|
COC1CC(CCC(=O)NCC2(NC(=O)Cc3ccno3)CC2)C1
|
COCCCCCC=O)NCCNC=O)Ccccno5))))))))CC3))))))))C4
|
[C][O][C][C][C][Branch2][Ring1][=N][C][C][C][=Branch1][C][=O][N][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][C][=C][C][=N][O][Ring1][Branch1][C][C][Ring1][N][C][Ring2][Ring1][=Branch1]
|
C16CC%10C1.C%10CC4=O.c19ccno1.C18%11CC1.C5(=O)C9.CO6.N47.C7%11.N58
|
Cc1ccccc1OCCC(=O)NC1CN(C(=O)c2cn(CCC3CC3)nn2)C1
|
Ccccccc6OCCC=O)NCCNC=O)ccnCCCCC3)))))nn5))))))C4
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][Branch1][Branch2][C][C][C][C][C][Ring1][Ring1][N][=N][Ring1][#Branch2][C][Ring1][S]
|
Cc1ccccc17.c19cn%10nn1.C6CC4=O.C18CN5C1.C59=O.C%10C%11.C1%11CC1.O67.N48
|
C[C@@H](Cc1cccnc1)C(=O)NC1CC(N(C)C(=O)CC2OCCCO2)C1
|
C[C@@H]Cccccnc6)))))))C=O)NCCCNC)C=O)CCOCCCO6)))))))))C4
|
[C][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][O][C][C][C][O][Ring1][=Branch1][C][Ring1][#C]
|
C[C@@H](C8)C3=O.c18cccnc1.C17OCCCO1.C15CC6C1.C4(=O)C7.N46C.N35
|
CCN1CCN(C(=O)CNC(=O)N2CC[C@](NC(C)=O)(c3noc(C)n3)C2)CC1
|
CCNCCNC=O)CNC=O)NCC[C@]NCC)=O)))cnocC)n5)))))C5)))))))))CC6
|
[C][C][N][C][C][N][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C][C][C@][Branch1][#Branch1][N][C][Branch1][C][C][=O][Branch1][O][C][=N][O][C][Branch1][C][C][=N][Ring1][=Branch1][C][Ring1][#C][C][C][Ring2][Ring1][O]
|
N18CCN4CC1.N16CC[C@]%10%11C1.c1%11noc(C)n1.C4(=O)C9.C56=O.C7(C)=O.CC8.N59.N7%10
|
CC1(C)OCC[C@@H]1C(=O)N[C@]12C[C@H]1CN(C(=O)c1cccnc1-n1cccn1)C2
|
CCC)OCC[C@@H]5C=O)N[C@]C[C@H]3CNC=O)ccccnc6-ncccn5))))))))))))C6
|
[C][C][Branch1][C][C][O][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@][C][C@H1][Ring1][Ring1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][=C][C][=N][Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
CC1(C)OCC[C@@H]16.[C@]125C[C@H]1CN4C2.c17cccnc18.n18cccn1.C36=O.C47=O.N35
|
CN(C(=O)[C@H]1[C@@H]2CN(C(=O)CCCC(F)(F)F)CC[C@@H]21)C1CC2(CC2)C1
|
CNC=O)[C@H][C@@H]CNC=O)CCCCF)F)F))))))CC[C@@H]67))))))))CCCCC3))C4
|
[C][N][Branch2][Ring1][P][C][=Branch1][C][=O][C@H1][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][C@@H1][Ring1][#C][Ring1][S][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=Branch1]
|
C4(=O)CCCC(F)(F)F.[C@@H]16[C@H]2CCN4C[C@@H]12.C15CC2(CC2)C1.CN35.C36=O
|
CCO[C@H](C(=O)N(C)[C@H]1CCCN(C(=O)C=Cc2cncnc2O)CC1)C1CC1
|
CCO[C@H]C=O)NC)[C@H]CCCNC=O)C=Cccncnc6O))))))))))CC7)))))))))CCC3
|
[C][C][O][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][N][=C][N][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][C][C][C][C][Ring1][Ring1]
|
[C@H]17CCCN4CC1.C=8c1cncnc1O.[C@H]69C3=O.C4(=O)C=8.N37C.C19CC1.CC5.O56
|
Cn1[nH]c(C(=O)N[C@@H]2CC[C@@](C)(CNC(=O)c3[nH]cnc3C#N)C2)nc1=O
|
Cn[nH]cC=O)N[C@@H]CC[C@@]C)CNC=O)c[nH]cnc5C#N))))))))))C5)))))))nc5=O
|
[C][N][NH1][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][C][C][C@@][Branch1][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][NH1][C][=N][C][=Ring1][Branch1][C][#N][C][Ring1][P][=N][C][Ring2][Ring1][=Branch2][=O]
|
Cn1[nH]c8nc1=O.[C@@H]17CC[C@]%10(C)C1.c19[nH]cnc1C#N.C48=O.C59=O.N47.C6%10.N56
|
O=C(CN(C(=O)[C@H]1CCC(F)(F)C1)C1CC1)NCCCc1nc[nH]n1
|
O=CCNC=O)[C@H]CCCF)F)C5))))))CCC3)))))NCCCcnc[nH]n5
|
[O][=C][Branch2][Ring1][N][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][C][C][Ring1][Ring1][N][C][C][C][C][N][=C][NH1][N][=Ring1][Branch1]
|
[C@H]17CCC(F)(F)C1.c18nc[nH]n1.O=C2C4.C5CC8.N346.C37=O.C16CC1.N25
|
C[C@@H]1CN(C(=O)[C@@H]2COCCN(C(=O)[C@@H]3CCCS3)C2)c2cccnc21
|
C[C@@H]CNC=O)[C@@H]COCCNC=O)[C@@H]CCCS5))))))C7))))))))ccccnc69
|
[C][C@@H1][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C@@H1][C][O][C][C][N][Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][S][Ring1][Branch1][C][Ring1][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring2][Ring1][=Branch2]
|
C[C@@H]1CN4c2cccnc21.[C@@H]17COCCN5C1.[C@@H]16CCCS1.C47=O.C56=O
|
CC[C@H](CN(C)C(=O)[C@@H](COC)OC)NC(=O)CN1CC(=O)NC1=O
|
CC[C@H]CNC)C=O)[C@@H]COC)))OC))))))NC=O)CNCC=O)NC5=O
|
[C][C][C@H1][Branch2][Ring1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Branch1][Ring2][C][O][C][O][C][N][C][=Branch1][C][=O][C][N][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O]
|
N18CC(=O)NC1=O.C2(=O)[C@H]5C4.CC[C@@H]6C7.C3(=O)C8.N27C.O4C.O5C.N36
|
CCC=C(F)C(=O)N[C@@H](C)C1CCN(C(=O)c2c[nH]c(C#N)c2)CC1
|
CCC=CF)C=O)N[C@@H]C)CCCNC=O)cc[nH]cC#N))c5))))))CC6
|
[C][C][C][=C][Branch1][C][F][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][NH1][C][Branch1][Ring1][C][#N][=C][Ring1][#Branch1][C][C][Ring1][#C]
|
C18CCN4CC1.c16c[nH]c(C#N)c1.C=7(F)C3=O.CCC=7.[C@@H]58C.C46=O.N35
|
C[C@H](CNC(=O)Cc1c(F)cccc1Cl)NC(=O)[C@@H]1CCN(C)C1=O
|
C[C@H]CNC=O)CccF)cccc6Cl)))))))))))NC=O)[C@@H]CCNC)C5=O
|
[C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][Cl][N][C][=Branch1][C][=O][C@@H1][C][C][N][Branch1][C][C][C][Ring1][=Branch1][=O]
|
c17c(F)cccc1Cl.[C@@H]16CCN(C)C1=O.C[C@@H]4C5.C2(=O)C7.C36=O.N25.N34
|
CCCC(C)(C)C(=O)N[C@H]1CCN(C(=O)C2=C(c3ccccc3)CCC2)C[C@@H]1O
|
CCCCC)C)C=O)N[C@H]CCNC=O)C=Ccccccc6))))))CCC5))))))C[C@@H]6O
|
[C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][O][C][C@@H1][Ring2][Ring1][Ring1][O]
|
C5(=O)C1=C(c2ccccc2)CCC1.CCCC(C)(C)C4=O.[C@H]16CCN5C[C@@H]1O.N46
|
CCc1nc(C(=O)NC[C@@H]2[C@H](C)CCCN2C(=O)[C@H](C)[C@H](O)[C@H](C)CC)cs1
|
CCcncC=O)NC[C@@H][C@H]C)CCCN6C=O)[C@H]C)[C@H]O)[C@H]C)CC)))))))))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][C@H1][Branch1][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@H1][Branch1][C][O][C@H1][Branch1][C][C][C][C][=C][S][Ring2][Ring1][#Branch2]
|
C4(=O)[C@H](C)[C@H](O)[C@H](C)CC.[C@@H]17[C@H](C)CCCN14.c18nc6cs1.C36=O.CC8.N35.C57
|
CCCC[C@H](C(=O)NCCCN1CC[C@H](NC(=O)C#C[C@@H]2CCOC2)C1)C(C)C
|
CCCC[C@H]C=O)NCCCNCC[C@H]NC=O)C#C[C@@H]CCOC5)))))))))C5))))))))))CC)C
|
[C][C][C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][N][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][#C][C@@H1][C][C][O][C][Ring1][Branch1][C][Ring1][#C][C][Branch1][C][C][C]
|
CCCC[C@H](C3=O)C(C)C.C4(=O)C#C[C@@H]1CCOC1.N16CC[C@H]7C1.C5CC6.N35.N47
|
CCC1(C(=O)N2CCC[C@H]2CNC(=O)C=C2C[C@H]3CC[C@@H](C2)N3C)CCCC1
|
CCCC=O)NCCC[C@H]5CNC=O)C=CC[C@H]CC[C@@H]C7)N5C))))))))))))))))))CCCC5
|
[C][C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][C][C][C][C][Ring2][Ring1][#Branch2]
|
C1=8C[C@H]2CC[C@@H](C1)N2C.C17%10CCCC1.N14CCC[C@H]19.C5(=O)C=8.C47=O.CC%10.C69.N56
|
C[C@H]1CC[C@@H](CN2CCOc3ccc(C(=O)O)cc32)OC1
|
C[C@H]CC[C@@H]CNCCOccccC=O)O))cc6%10)))))))))))OC6
|
[C][C@H1][C][C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][C][O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][Ring1][=N][O][C][Ring2][Ring1][Ring2]
|
N14CCOc2ccc5cc21.C[C@H]1CC[C@@H]6OC1.C5(=O)O.C46
|
C[C@H](CCNC(=O)Cn1cc(CO)nn1)NC(=O)[C@@H]1CCC(C)(C)OC1
|
C[C@H]CCNC=O)CnccCO))nn5))))))))))NC=O)[C@@H]CCCC)C)OC6
|
[C][C@H1][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][N][C][=C][Branch1][Ring1][C][O][N][=N][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][Branch2]
|
[C@@H]16CCC(C)(C)OC1.n17cc8nn1.C[C@@H]4CC5.C2(=O)C7.C36=O.N25.C8O.N34
|
CCCCCCNc1nc2c(cc1[N+](=O)[O-])CCCC2
|
CCCCCCNcncccc6[N+]=O)[O-]))))CCCC6
|
[C][C][C][C][C][C][N][C][=N][C][=C][Branch1][#Branch2][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][C][C][C][C][Ring1][O]
|
c14nc2c(cc1[N+](=O)[O-])CCCC2.CCCCCC3.N34
|
COc1ccc(Cl)cc1[C@H](C)NC(=O)Cn1c(C)cc(O)cc1=O
|
COccccCl)cc6[C@H]C)NC=O)CncC)ccO)cc6=O
|
[C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][C][Branch1][C][C][=C][C][Branch1][C][O][=C][C][Ring1][Branch2][=O]
|
n15c(C)cc(O)cc1=O.c13ccc(Cl)cc16.C2(=O)C5.[C@@H]46C.CO3.N24
|
Cc1cc(C)nc(C(=O)N[C@@H]2CCC23CN(C(=O)c2csc(Br)n2)C3)c1
|
CcccC)ncC=O)N[C@@H]CCC4CNC=O)ccscBr)n5))))))C4)))))))))c6
|
[C][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][C][C][C][Ring1][Ring2][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Br][=N][Ring1][=Branch1][C][Ring1][N][=C][Ring2][Ring1][=Branch2]
|
Cc1cc7nc(C)c1.[C@@H]16CCC12CN5C2.c18csc(Br)n1.C47=O.C58=O.N46
|
Cc1cc(CC(=O)N[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3NC(=O)c2cc(CO)[nH]n2)nn1C
|
CcccCC=O)N[C@H]CO[C@H][C@@H]5OC[C@@H]5NC=O)cccCO))[nH]n5))))))))))))))))))nn5C
|
[C][C][=C][C][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C@H1][C][O][C@H1][C@@H1][Ring1][Branch1][O][C][C@@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][=C][Branch1][Ring1][C][O][NH1][N][=Ring1][#Branch1][=N][N][Ring2][Ring1][O][C]
|
[C@H]16CO[C@H]2[C@@H]1OC[C@@H]27.Cc1cc9nn1C.c18cc%10[nH]n1.C9C4=O.C58=O.N46.N57.C%10O
|
CCCC[C@H](C(=O)Nc1ccc(N2CCCCC2)cc1F)N1CCCS1(=O)=O
|
CCCC[C@H]C=O)NccccNCCCCC6))))))cc6F)))))))))NCCCS5=O)=O
|
[C][C][C][C][C@H1][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][N][F][N][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O]
|
CCCC[C@@H]4C3=O.c15ccc6cc1F.N14CCCS1(=O)=O.N16CCCCC1.N35
|
CC1(C[S@](C)(=O)=NC(=O)c2cc(CN)no2)CNC1
|
CCC[S@]C)=O)=NC=O)cccCN))no5)))))))))CNC4
|
[C][C][Branch2][Ring1][=Branch2][C][S@][Branch1][C][C][=Branch1][C][=O][=N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][C][N][=N][O][Ring1][#Branch1][C][N][C][Ring2][Ring1][C]
|
C5[S@](C)(=O)=NC3=O.c13cc4no1.CC15CNC1.C4N
|
Cc1nn(C)cc1CC(=O)NC[C@](C)(NC(=O)[C@H]1CCCS1)C1CC1
|
CcnnC)cc5CC=O)NC[C@]C)NC=O)[C@H]CCCS5)))))))CCC3
|
[C][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][C][C][S][Ring1][Branch1][C][C][C][Ring1][Ring1]
|
Cc1nn(C)cc18.C4[C@]57C.[C@H]16CCCS1.C8C2=O.C36=O.C17CC1.N24.N35
|
Cc1cc(N)cnc1C(=O)NC[C@@H]1CCCCN(C(=O)[C@@H]2Cc3nncn3C2)C1
|
CcccN)cnc6C=O)NC[C@@H]CCCCNC=O)[C@@H]Ccnncn5C8)))))))))C7
|
[C][C][=C][C][Branch1][C][N][=C][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][C][C][=N][N][=C][N][Ring1][Branch1][C][Ring1][Branch2][C][Ring1][P]
|
Cc1cc(N)cnc17.[C@@H]19CCCCN5C1.[C@@H]18Cc2nncn2C1.C47=O.C58=O.N46.C69
|
CC[C@H](CC(=O)N1C[C@H]2CCC[C@@H](C1)N2c1cnc2ccccc2n1)CN(C)C
|
CC[C@H]CC=O)NC[C@H]CCC[C@@H]C8)N6ccncccccc6n%10))))))))))))))))))))CNC)C
|
[C][C][C@H1][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C@H1][C][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch2][N][Ring1][#Branch1][C][=C][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][N][Branch1][C][C][C]
|
N13C[C@H]2CCC[C@@H](C1)N25.c15cnc2ccccc2n1.CC[C@@H](C4)CC3=O.N4(C)C
|
Cc1ncc(C(=O)N[C@H](CNC(=O)[C@@H](F)C2(O)CCCC2)C(C)C)c(=N)[nH]1
|
CcnccC=O)N[C@H]CNC=O)[C@@H]F)CO)CCCC5)))))))))CC)C)))))c=N)[nH]6
|
[C][C][=N][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][Branch1][C][O][C][C][C][C][Ring1][=Branch1][C][Branch1][C][C][C][C][=Branch1][C][=N][NH1][Ring2][Ring1][#Branch2]
|
Cc1ncc7c(=N)[nH]1.[C@@H]5(C6)C(C)C.C18(O)CCCC1.C4(=O)[C@H]8F.C37=O.N35.N46
|
CC=CCC(=O)NC1(CNC(=O)COCC)Cc2ccccc2C1
|
CC=CCC=O)NCCNC=O)COCC)))))))Ccccccc6C9
|
[C][C][=C][C][C][=Branch1][C][=O][N][C][Branch1][O][C][N][C][=Branch1][C][=O][C][O][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P]
|
C17%10Cc2ccccc2C1.C=9CC3=O.C4(=O)C5.CC=9.N37.C8%10.N48.O56.C6C
|
C[C@@H]1CN(C(=O)c2ccc3cnnn3c2)CC[C@H]1CNC(=O)COCCN(C)C
|
C[C@@H]CNC=O)cccccnnn5c9))))))))))CC[C@H]6CNC=O)COCCNC)C
|
[C][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][=C][C][=C][N][=N][N][Ring1][Branch1][C][=Ring1][=Branch2][C][C][C@H1][Ring1][P][C][N][C][=Branch1][C][=O][C][O][C][C][N][Branch1][C][C][C]
|
c1%10ccc2cnnn2c1.C[C@@H]1CN4CC[C@H]1%11.C5(=O)C6.C4%10=O.C7C9.N9(C)C.C8%11.N58.O67
|
CO[C@H](C(=O)NCC1=CCN(C(=O)CC2(O)CC2)CC1)c1ccccc1F
|
CO[C@H]C=O)NCC=CCNC=O)CCO)CC3)))))CC6)))))))))cccccc6F
|
[C][O][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][=C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][Ring1][Ring2][C][C][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][F]
|
C6C1=CCN4CC1.c18ccccc1F.[C@H]58C3=O.C4(=O)C7.C17(O)CC1.CO5.N36
|
CN(CC1(C)CCCC1)C(=O)C1(CCNC(=O)c2ccnc(O)c2F)CC1
|
CNCCC)CCCC5))))))C=O)CCCNC=O)cccncO)c6F)))))))))))CC3
|
[C][N][Branch1][N][C][C][Branch1][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1][F][C][C][Ring1][S]
|
c18ccnc(O)c1F.C19(C)CCCC1.C17%10CC1.CN35.C37=O.C%10C6.C48=O.C59.N46
|
Cc1cnc(CCC(=O)N(C)[C@@H]2CN(C(=O)C=C3CCN(C)CC3)C[C@@H]2F)[nH]1
|
CccncCCC=O)NC)[C@@H]CNC=O)C=CCCNC)CC6))))))))C[C@@H]5F))))))))))[nH]5
|
[C][C][=C][N][=C][Branch2][Ring2][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][C@@H1][Ring1][#C][F][NH1][Ring2][Ring1][O]
|
[C@@H]16CN5C[C@@H]1F.C1=7CCN(C)CC1.Cc1cnc8[nH]1.C8CC4=O.C5(=O)C=7.N46C
|
CC[C@]1(C(=O)N(C)C2(CO)CC2)CCCN(C(=O)[C@@H]2CCC2(F)F)C1
|
CC[C@]C=O)NC)CCO))CC3)))))CCCNC=O)[C@@H]CCC4F)F))))))C6
|
[C][C][C@][Branch2][Ring1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Branch1][Ring1][C][O][C][C][Ring1][Branch1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@@H1][C][C][C][Ring1][Ring2][Branch1][C][F][F][C][Ring2][Ring1][#Branch1]
|
[C@]168CCCN4C1.[C@@H]17CCC1(F)F.C159CC1.C36=O.N35C.C47=O.CC8.C9O
|
CC12CCOC(C(=O)NCCCCCCNC(=O)[C@@H]3CC(=O)NC(=O)N3)(C1)C2
|
CCCCOCC=O)NCCCCCCNC=O)[C@@H]CC=O)NC=O)N6))))))))))))))))C6)C6
|
[C][C][C][C][O][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][N][Ring1][Branch2][Branch1][Branch1][C][Ring2][Ring1][#Branch2][C][Ring2][Ring1][O]
|
CC12CCOC8(C1)C2.[C@@H]19CC(=O)NC(=O)N1.C6CCCCC7.C48=O.C59=O.N46.N57
|
C=Cc1ccc(C(=O)N[C@@H]2CCC[C@H](NC(=O)c3[nH]nnc3C)C2)cc1
|
C=CccccC=O)N[C@@H]CCC[C@H]NC=O)c[nH]nnc5C))))))))C6))))))))cc6
|
[C][=C][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][NH1][N][=N][C][=Ring1][Branch1][C][C][Ring1][#C][C][=C][Ring2][Ring1][Branch2]
|
C=Cc1ccc9cc1.[C@@H]16CCC[C@H]7C1.c18[nH]nnc1C.C49=O.C58=O.N46.N57
|
O=C(/C=C/c1cnc[nH]1)Nc1cnn(C2CN(C(=O)COC3CCCC3)C2)c1
|
O=C/C=C/ccnc[nH]5)))))))NccnnCCNC=O)COCCCCC5))))))))C4))))c5
|
[O][=C][Branch1][#Branch2][/C][=C][/C][=C][N][=C][NH1][Ring1][Branch1][N][C][C][=N][N][Branch2][Ring1][=Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][O][C][C][C][C][C][Ring1][Branch1][C][Ring1][=N][C][=Ring2][Ring1][C]
|
C=9c1cnc[nH]1.c18cnn%10c1.C1%10CN5C1.C17CCCC1.O=C4C=9.C5(=O)C6.N48.O67
|
CCS(=O)(=O)N1CC(C(=O)N[C@H](C)C2CN(C(=O)CCn3ccccc3=O)C2)C1
|
CCS=O)=O)NCCC=O)N[C@H]C)CCNC=O)CCnccccc6=O))))))))))C4)))))))C4
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][N][C][=C][C][=C][C][Ring1][=Branch1][=O][C][Ring1][#C][C][Ring2][Ring1][Branch2]
|
n19ccccc1=O.CCS7(=O)=O.N17CC8C1.C1%10CN5C1.C5(=O)CC9.C48=O.[C@H]6%10C.N46
|
CSc1ccc(C(=O)N2CC[C@H](C)[C@@H]2CNC(=O)COCC(C)(C)C)cc1
|
CSccccC=O)NCC[C@H]C)[C@@H]5CNC=O)COCCC)C)C))))))))))))))cc6
|
[C][S][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][O][C][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring2][Ring1][=Branch2]
|
c1%10ccc8cc1.N13CC[C@H](C)[C@@H]19.C6C(C)(C)C.C4(=O)C5.C38=O.CS%10.C79.N47.O56
|
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