SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
---|---|---|---|
CN(C[C@H]1CCN(C(=O)CO)C1)C(=O)C1([C@H](O)C(F)(F)F)CCC1
|
CNC[C@H]CCNC=O)CO)))C5))))))C=O)C[C@H]O)CF)F)F)))CCC4
|
[C][N][Branch1][P][C][C@H1][C][C][N][Branch1][#Branch1][C][=Branch1][C][=O][C][O][C][Ring1][=Branch2][C][=Branch1][C][=O][C][Branch1][=N][C@H1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F][C][C][C][Ring1][#Branch2]
|
[C@H]16CCN2C1.[C@@H]7(O)C(F)(F)F.C157CCC1.C2(=O)CO.CN34.C35=O.C46
|
C[C@H](C(=O)N1C[C@@H]2CN(C(=O)[C@@]3(C#N)C[C@H]4C=C[C@H]3C4)C[C@@H]2C1)N1CCC1
|
C[C@H]C=O)NC[C@@H]CNC=O)[C@@]C#N))C[C@H]C=C[C@H]6C5))))))))C[C@@H]5C8)))))))))NCCC4
|
[C][C@H1][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][#N][C][C@H1][C][=C][C@H1][Ring1][Branch2][C][Ring1][Branch1][C][C@@H1][Ring1][S][C][Ring2][Ring1][Ring1][N][C][C][C][Ring1][Ring2]
|
N15C[C@@H]2CN6C[C@@H]2C1.[C@]18(C#N)C[C@H]2C=C[C@H]1C2.C[C@@H]7C5=O.N17CCC1.C68=O
|
C=C(C)CCC(=O)N1CC[C@@](CNC(=O)CCOCC2CC2)(C(C)(C)C)C1
|
C=CC)CCC=O)NCC[C@@]CNC=O)CCOCCCC3))))))))))CC)C)C))C5
|
[C][=C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][S][C][N][C][=Branch1][C][=O][C][C][O][C][C][C][C][Ring1][Ring1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring2][Ring1][Ring2]
|
C=C(C)CCC3=O.N13CC[C@@]8%10C1.C4(=O)CC5.C%10(C)(C)C.C19CC1.C78.N47.O56.C69
|
CCCc1ncoc1C(=O)NC[C@@H](C)CN(C)C(=O)COCCc1ccccc1
|
CCCcncoc5C=O)NC[C@@H]C)CNC)C=O)COCCcccccc6
|
[C][C][C][C][N][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
c19ncoc18.c1%10ccccc1.C6[C@@H](C)C7.C3(=O)C4.CCC9.C28=O.N37C.C5C%10.N26.O45
|
C[C@@]1(C(=O)NCCC[C@@H]2CN(C(=O)Cc3csnn3)CCO2)CC=CCC1
|
C[C@@]C=O)NCCC[C@@H]CNC=O)Cccsnn5)))))))CCO6)))))))))))CC=CCC6
|
[C][C@@][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][C][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][N][=N][Ring1][Branch1][C][C][O][Ring1][=C][C][C][=C][C][C][Ring2][Ring1][#Branch2]
|
C[C@@]17CC=CCC1.[C@@H]18CN5CCO1.c19csnn1.C6CC8.C5(=O)C9.C47=O.N46
|
COC[C@@]1(CNC(=O)C2=CCCS2)CCCN1C(=O)Cc1cccc(Cl)c1
|
COC[C@@]CNC=O)C=CCCS5))))))))CCCN5C=O)CcccccCl)c6
|
[C][O][C][C@@][Branch1][=C][C][N][C][=Branch1][C][=O][C][=C][C][C][S][Ring1][Branch1][C][C][C][N][Ring1][=C][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]
|
[C@]178CCCN14.C3(=O)C1=CCCS1.c19cccc(Cl)c1.C4(=O)C9.CO5.C57.C68.N36
|
CC[C@H](CNC(=O)[C@H]1CCN(c2ccccc2)C1)NC(=O)C[C@@H]1COC2CC1C2
|
CC[C@H]CNC=O)[C@H]CCNcccccc6))))))C5))))))))NC=O)C[C@@H]COCCC6C4
|
[C][C][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C@H1][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][N][C][=Branch1][C][=O][C][C@@H1][C][O][C][C][C][Ring1][=Branch1][C][Ring1][Ring2]
|
[C@@H]19COC2CC1C2.[C@H]18CCN7C1.c17ccccc1.CC[C@@H]5C6.C4(=O)C9.C38=O.N36.N45
|
C#Cc1cc(C(=O)N(CC)CCC(=O)NC[C@H](C)CC2CC2)ccc1C
|
C#CcccC=O)NCC))CCC=O)NC[C@H]C)CCCC3))))))))))))ccc6C
|
[C][#C][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C][C][C][Ring1][Ring1][=C][C][=C][Ring2][Ring1][#Branch1][C]
|
C#Cc1cc8ccc1C.C6CC4=O.C7[C@H](C)C9.C38=O.N356.C19CC1.C5C.N47
|
Cc1nn(CCO)c(C)c1C(=O)N1CCOC[C@@H](NC(=O)C=Cc2cocn2)C1
|
CcnnCCO)))cC)c5C=O)NCCOC[C@@H]NC=O)C=Cccocn5)))))))))C7
|
[C][C][=N][N][Branch1][Ring2][C][C][O][C][Branch1][C][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][O][C][=N][Ring1][Branch1][C][Ring1][P]
|
Cc1nn8c(C)c16.N13CCOC[C@@H]5C1.C=7c1cocn1.C4(=O)C=7.C8CO.C36=O.N45
|
Cc1n[nH]cc1C(=O)N1Cc2ccccc2C[C@H]1CNC(=O)C1(S(C)(=O)=O)CC1
|
Ccn[nH]cc5C=O)NCcccccc6C[C@H]%10CNC=O)CSC)=O)=O))CC3
|
[C][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][#Branch1]
|
N13Cc2ccccc2C[C@H]18.C16(S(C)(=O)=O)CC1.Cc1n[nH]cc17.C37=O.C46=O.C58.N45
|
C=CCC(F)(F)C(=O)NC[C@H]1CCN(C(=O)c2cc(Cl)ncc2NC)C[C@@H]1C
|
C=CCCF)F)C=O)NC[C@H]CCNC=O)cccCl)ncc6NC)))))))))C[C@@H]6C
|
[C][=C][C][C][Branch1][C][F][Branch1][C][F][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][N][C][C][C@@H1][Ring1][P][C]
|
C=CCC(F)(F)C3=O.[C@H]18CCN4C[C@@H]1C.c17cc(Cl)ncc16.C47=O.N35.C58.N6C
|
CCN(CCNC(=O)[C@@H](F)CC1CC1)C(=O)c1cccc(C(=O)OC(C)(C)C)c1
|
CCNCCNC=O)[C@@H]F)CCCC3)))))))))C=O)cccccC=O)OCC)C)C))))c6
|
[C][C][N][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=N]
|
c1%10cccc%11c1.C4(=O)[C@@H](F)C3.C6(C)(C)C.N578.C8C9.C13CC1.C5%10=O.C2%11=O.CC7.N49.O26
|
CCN=c1[nH]c(C(=O)NCC#CCNC(=O)c2ccccc2C)cs1
|
CCN=c[nH]cC=O)NCC#CCNC=O)cccccc6C)))))))))))))))cs5
|
[C][C][N][=C][NH1][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][#C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][S][Ring2][Ring1][=Branch1]
|
CCN=c1[nH]c7cs1.c18ccccc1C.C5C#CC6.C37=O.C48=O.N35.N46
|
CS(=O)(=O)C1(C(=O)N2CCC([C@@H]3C[C@H]3NC(=O)[C@H]3CC34CC(O)C4)CC2)CC1
|
CS=O)=O)CC=O)NCCC[C@@H]C[C@H]3NC=O)[C@H]CC3CCO)C4)))))))))))CC6)))))))CC3
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch2][C@@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][Branch1][C][O][C][Ring1][Branch1][C][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][Branch2]
|
N15CCC([C@@H]2C[C@H]27)CC1.CS(=O)(=O)C18CC1.[C@H]19CC12CC(O)C2.C58=O.C69=O.N67
|
CCCN(C(=O)C1CC2(CC(=O)C2)C1)[C@H](C)C(=O)NC1CN(CC(F)F)C1
|
CCCNC=O)CCCCC=O)C4)))C4)))))[C@H]C)C=O)NCCNCCF)F)))C4
|
[C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][Branch1][=Branch2][C][C][=Branch1][C][=O][C][Ring1][Branch1][C][Ring1][Branch2][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C][Branch1][C][F][F][C][Ring1][Branch2]
|
C19CC2(CC(=O)C2)C1.[C@@H]6(C)C4=O.C18CN7C1.C7C(F)F.CCC5.N356.C39=O.N48
|
COc1cc(C(=O)NCc2ccc3c(c2)CN(C(=O)[C@@H](F)OC)C3)cc(F)c1F
|
COcccC=O)NCcccccc6)CNC=O)[C@@H]F)OC))))C5)))))))))))ccF)c6F
|
[C][O][C][=C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][Branch1][O][C][=Branch1][C][=O][C@@H1][Branch1][C][F][O][C][C][Ring1][N][=C][C][Branch1][C][F][=C][Ring2][Ring1][#Branch2][F]
|
c1%10ccc2c(c1)CN5C2.c17cc9cc(F)c1F.C5(=O)[C@H]6F.C49=O.CO7.N48.C8%10.O6C
|
Cc1ccoc1C(=O)NC[C@@H]1CC(F)(F)CN1C(=O)[C@@H]1C[C@@H](O)CN1C(N)=O
|
Ccccoc5C=O)NC[C@@H]CCF)F)CN5C=O)[C@@H]C[C@@H]O)CN5CN)=O
|
[C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch1][C][F][Branch1][C][F][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][Branch1][C][N][=O]
|
[C@@H]18CC(F)(F)CN13.[C@@H]16C[C@@H](O)CN14.Cc1ccoc17.C27=O.C36=O.C4(N)=O.N25.C58
|
CN(CC(=O)NC[C@@H](O)CNC(=O)COc1cc(F)cc(F)c1)[C@@H]1CCC[C@H]1O
|
CNCC=O)NC[C@@H]O)CNC=O)COcccF)ccF)c6))))))))))))))))[C@@H]CCC[C@H]5O
|
[C][N][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C@@H1][C][C][C][C@H1][Ring1][Branch1][O]
|
c15cc(F)cc(F)c1.[C@@H]19CCC[C@H]1O.C7[C@@H](O)C8.C6C2=O.C3(=O)C4.CN69.N27.N38.O45
|
C[C@@H](CNC(=O)C(C)(C)c1ncco1)CNC(=O)[C@]1(c2ccccc2)C[C@@H](F)C1
|
C[C@@H]CNC=O)CC)C)cncco5)))))))))CNC=O)[C@]cccccc6))))))C[C@@H]F)C4
|
[C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=N][C][=C][O][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@@H1][Branch1][C][F][C][Ring1][O]
|
C3(=O)C8(C)C.[C@]179C[C@H](F)C1.c19ccccc1.C[C@@H](C5)C6.c18ncco1.C47=O.N35.N46
|
C=CCCCC(=O)Nc1cccc(NC(=O)c2ccc3ncn(C)c3n2)c1
|
C=CCCCC=O)NcccccNC=O)ccccncnC)c5n9)))))))))))c6
|
[C][=C][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][N][Branch1][C][C][C][Ring1][=Branch1][=N][Ring1][#Branch2][=C][Ring2][Ring1][Ring1]
|
c18ccc2ncn(C)c2n1.C=CCCCC4=O.c16cccc7c1.C58=O.N46.N57
|
N[C@H]1CCC[C@@H](CN2CCC3(CC2)C[C@H]3C(=O)NCCc2nc3c(s2)CCC3)C1
|
N[C@H]CCC[C@@H]CNCCCCC6))C[C@H]3C=O)NCCcnccs5)CCC5))))))))))))))))))C6
|
[N][C@H1][C][C][C][C@@H1][Branch2][Ring2][Branch1][C][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][N]
|
N15CCC2(CC1)C[C@H]27.c18nc2c(s1)CCC2.N[C@H]1CCC[C@@H]9C1.C47=O.C6C8.C59.N46
|
CCC(=O)N[C@@H](C)C(=O)N[C@H](C)CCNC(=O)C1CC(C2CCC2)C1
|
CCC=O)N[C@@H]C)C=O)N[C@H]C)CCNC=O)CCCCCCC4))))C4
|
[C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][Branch2]
|
C19CC(C2CCC2)C1.[C@H]6(C)C4=O.[C@@H]7(C)CC8.CCC3=O.C59=O.N36.N47.N58
|
C=Cn1nccc1C(=O)NC[C@@H]1[C@H]2CC[C@H](C2)N1C(=O)[C@]1(C)CC=CCO1
|
C=Cnnccc5C=O)NC[C@@H][C@H]CC[C@H]C5)N6C=O)[C@]C)CC=CCO6
|
[C][=C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][Branch1][N][Ring1][#Branch1][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][=C][C][O][Ring1][#Branch1]
|
[C@@H]18[C@H]2CC[C@H](C2)N14.C=Cn1nccc17.[C@@]16(C)CC=CCO1.C37=O.C46=O.N35.C58
|
CSCC1(C)CN(C(=O)[C@H](O)CNC(=O)[C@@H]2CCNC2=O)C1
|
CSCCC)CNC=O)[C@H]O)CNC=O)[C@@H]CCNC5=O)))))))))))C4
|
[C][S][C][C][Branch1][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C@@H1][C][C][N][C][Ring1][Branch1][=O][C][Ring2][Ring1][Ring1]
|
C18(C)CN3C1.C3(=O)[C@H](O)C5.[C@@H]17CCNC1=O.C47=O.CS6.C68.N45
|
CCSC[C@H](NC(=O)[C@@H]1CC12CCCC2)C(=O)Nc1cccc(CO)c1C
|
CCSC[C@H]NC=O)[C@@H]CC3CCCC5)))))))))C=O)NcccccCO))c6C
|
[C][C][S][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][Ring1][C][O][=C][Ring1][Branch2][C]
|
c18cccc%10c1C.[C@@H]19CC12CCCC2.C7[C@H]5C4=O.C39=O.CC6.S67.N35.N48.C%10O
|
COC1(CNc2cc(N[C@@H]3CCCc4c[nH]nc43)nc(C)n2)CCCCC1
|
COCCNcccN[C@@H]CCCcc[nH]nc59))))))))))ncC)n6))))))))CCCCC6
|
[C][O][C][Branch2][Ring1][=C][C][N][C][=C][C][Branch1][#C][N][C@@H1][C][C][C][C][=C][NH1][N][=C][Ring1][Branch1][Ring1][=Branch2][=N][C][Branch1][C][C][=N][Ring1][P][C][C][C][C][C][Ring2][Ring1][=Branch2]
|
N8[C@@H]1CCCc2c[nH]nc21.c17cc8nc(C)n1.C159CCCCC1.CO5.C69.N67
|
O=C(C[C@@H]1CC[C@H](O)C1)N[C@@H](Cc1cnc[nH]1)C(=O)NCc1ccns1
|
O=CC[C@@H]CC[C@H]O)C5))))))N[C@@H]Cccnc[nH]5))))))C=O)NCcccns5
|
[O][=C][Branch1][N][C][C@@H1][C][C][C@H1][Branch1][C][O][C][Ring1][=Branch1][N][C@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=N][S][Ring1][Branch1]
|
[C@@H]18CC[C@H](O)C1.[C@H]4(C6)C3=O.c16cnc[nH]1.c17ccns1.O=C2C8.N24.N35.C57
|
CCCCOCCOCCN[C@H](C)c1ccc(F)c(I)c1
|
CCCCOCCOCCN[C@H]C)ccccF)cI)c6
|
[C][C][C][C][O][C][C][O][C][C][N][C@H1][Branch1][C][C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][I][=C][Ring1][Branch2]
|
c18ccc(F)c(I)c1.CCCC2.C3C4.C5C6.[C@H]78C.O23.O45.N67
|
C=CC1(C(=O)N2CCC(CCOC)(NC(=O)[C@@H](C)C(F)F)CC2)CCC1
|
C=CCC=O)NCCCCCOC))))NC=O)[C@@H]C)CF)F)))))CC6)))))))CCC4
|
[C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][O][C][Branch1][#C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][Branch1][C][F][F][C][C][Ring2][Ring1][C][C][C][C][Ring2][Ring1][Branch2]
|
N13CCC68CC1.C4(=O)[C@@H](C)C(F)F.C=CC17CCC1.C37=O.C8C5.O5C.N46
|
N#CCCNC(=O)[C@H](c1ncccc1Br)N1CCO[C@H]2[C@H](O)C[C@H]21
|
N#CCCNC=O)[C@H]cncccc6Br)))))))NCCO[C@H][C@H]O)C[C@H]48
|
[N][#C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][=N][C][=C][C][=C][Ring1][=Branch1][Br][N][C][C][O][C@H1][C@H1][Branch1][C][O][C][C@H1][Ring1][Branch1][Ring1][=Branch2]
|
N15CCO[C@H]2[C@H](O)C[C@H]21.c16ncccc1Br.C3(=O)[C@@H]56.N#CCC4.N34
|
CC(C)c1ccc(-c2nc(CC3CCC3)n([C@H]3CCO[C@@H]3C)n2)cc1
|
CCC)cccc-cncCCCCC4)))))n[C@H]CCO[C@@H]5C))))))n5)))))cc6
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][O][C][N][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][N][Branch1][=Branch2][C@H1][C][C][O][C@@H1][Ring1][Branch1][C][N][=Ring1][S][C][=C][Ring2][Ring1][=Branch1]
|
c16ccc8cc1.c18nc4n7n1.[C@H]17CCO[C@@H]1C.C15CCC1.CC6C.C45
|
CCc1nonc1C(=O)NCC(=O)NCC(=O)N[C@H]1CCN2CCC[C@H]2C1
|
CCcnonc5C=O)NCC=O)NCC=O)N[C@H]CCNCCC[C@H]5C9
|
[C][C][C][=N][O][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@H1][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][Ring1][=Branch2]
|
[C@H]18CCN2CCC[C@H]2C1.c1%10nonc19.C6C4=O.C7C5=O.C39=O.CC%10.N36.N47.N58
|
CC=C(C)C(=O)N(CCNC(=O)[C@@H]1CCN2CCC[C@H]2C1)Cc1ccc(Cl)nc1
|
CC=CC)C=O)NCCNC=O)[C@@H]CCNCCC[C@H]5C9)))))))))))))CccccCl)nc6
|
[C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][N][C][C][C][C@H1][Ring1][Branch1][C][Ring1][=Branch2][C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1]
|
[C@@H]18CCN2CCC[C@H]2C1.c1%10ccc(Cl)nc1.C=9(C)C3=O.N357.C5C6.C48=O.CC=9.N46.C7%10
|
Cc1ccc(C(=O)N[C@@H]2CC[C@H](CNC(=O)c3nccn3C)C2)cc1O
|
CccccC=O)N[C@@H]CC[C@H]CNC=O)cnccn5C)))))))))C5)))))))cc6O
|
[C][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][=N][C][=C][N][Ring1][Branch1][C][C][Ring1][#C][C][=C][Ring2][Ring1][Branch2][O]
|
Cc1ccc9cc1O.[C@@H]17CC[C@H]%10C1.c18nccn1C.C49=O.C58=O.N47.C6%10.N56
|
C=C(C)COCC(=O)N1C[C@H]2COCC[C@@]2(NC(=O)C=C(C)C(F)F)C1
|
C=CC)COCC=O)NC[C@H]COCC[C@@]6NC=O)C=CC)CF)F))))))C9
|
[C][=C][Branch1][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][C][O][C][C][C@@][Ring1][=Branch1][Branch1][S][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][Branch1][C][F][F][C][Ring2][Ring1][C]
|
N13C[C@H]2COCC[C@@]27C1.C=8(C)C(F)F.C=C(C)C5.C6C3=O.C4(=O)C=8.O56.N47
|
CCOC(=O)c1cccc(C(=O)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2cnc(C)[nH]2)C3)c1
|
CCOC=O)cccccC=O)N[C@@H]CC[C@H]5[C@H]NC=O)ccncC)[nH]5)))))))C6))))))))c6
|
[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Ring1][Branch1][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][NH1][Ring1][=Branch1][C][Ring1][#C][=C][Ring2][Ring1][Branch2]
|
N15[C@@H]2CC[C@H]1[C@H]8C2.c1%10cccc%11c1.c19cnc(C)[nH]1.C4%10=O.C5%11=O.C69=O.CC7.O47.N68
|
Cc1cnc(C(=O)NCC[C@H]2CN(C(=O)c3n[nH]c(C)c3C)CCO2)c(C)c1
|
CccncC=O)NCC[C@H]CNC=O)cn[nH]cC)c5C)))))))CCO6))))))))))cC)c6
|
[C][C][=C][N][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][C][O][Ring1][#C][C][Branch1][C][C][=C][Ring2][Ring1][O]
|
Cc1cnc7c(C)c1.[C@H]19CN5CCO1.c18n[nH]c(C)c1C.C47=O.C6C9.C58=O.N46
|
CCO[C@H](C)C(=O)NC[C@@H](CCOC)NC(=O)c1cncc(Cl)c1Cl
|
CCO[C@H]C)C=O)NC[C@@H]CCOC))))NC=O)ccnccCl)c6Cl
|
[C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Branch1][C][C][O][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl]
|
c19cncc(Cl)c1Cl.C7[C@H]8CC6.[C@@H]5(C)C2=O.C39=O.CC4.O45.N27.O6C.N38
|
COC(=O)[C@H]1CCN(C(=O)[C@@H]2CC[C@H](n3cc(C4CC(=O)C4)nn3)C2)C1
|
COC=O)[C@H]CCNC=O)[C@@H]CC[C@H]nccCCC=O)C4))))nn5)))))C5))))))C5
|
[C][O][C][=Branch1][C][=O][C@H1][C][C][N][Branch2][Ring1][P][C][=Branch1][C][=O][C@@H1][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=C][Branch1][#Branch2][C][C][C][=Branch1][C][=O][C][Ring1][Branch1][N][=N][Ring1][#Branch2][C][Ring1][#C][C][Ring2][Ring1][=Branch1]
|
[C@H]17CCN6C1.[C@@H]18CC[C@H]9C1.n19cc%10nn1.C1%10CC(=O)C1.C57=O.C68=O.CO5
|
Cc1nn(C)cc1C(=O)N[C@@H]1CN(C(=O)C(C)(C)S(C)(=O)=O)Cc2nccn2C1
|
CcnnC)cc5C=O)N[C@@H]CNC=O)CC)C)SC)=O)=O))))Ccnccn5C%10
|
[C][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][=N][C][=C][N][Ring1][Branch1][C][Ring2][Ring1][Ring1]
|
[C@@H]15CN4Cc2nccn2C1.C4(=O)C(C)(C)S(C)(=O)=O.Cc1nn(C)cc16.C36=O.N35
|
FC(F)(F)Oc1ccc(-n2nc([C@@H]3CCOC3)nc2-c2cnon2)cc1
|
FCF)F)Occcc-nnc[C@@H]CCOC5)))))nc5-ccnon5))))))))))cc6
|
[F][C][Branch1][C][F][Branch1][C][F][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][N][=C][Branch1][Branch2][C@@H1][C][C][O][C][Ring1][Branch1][N][=C][Ring1][#Branch2][C][C][=N][O][N][=Ring1][Branch1][C][=C][Ring2][Ring1][Branch1]
|
c14ccc5cc1.n15nc7nc16.FC(F)(F)O4.[C@@H]17CCOC1.c16cnon1
|
CC[C@@H]1CCN(C(=O)CSC(F)(F)F)[C@@H]1C(=O)N(C)[C@@H]1CCC[C@H](O)C1
|
CC[C@@H]CCNC=O)CSCF)F)F)))))[C@@H]5C=O)NC)[C@@H]CCC[C@H]O)C6
|
[C][C][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][S][C][Branch1][C][F][Branch1][C][F][F][C@@H1][Ring1][=N][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][C][C][C@H1][Branch1][C][O][C][Ring1][#Branch1]
|
[C@@H]17CCN2[C@@H]16.[C@@H]15CCC[C@H](O)C1.S4C(F)(F)F.C2(=O)C4.C36=O.N35C.CC7
|
CCOc1ncc(NC(=O)[C@H]2CCC[C@H]2NC(=O)CCCCC#N)cn1
|
CCOcnccNC=O)[C@H]CCC[C@H]5NC=O)CCCCC#N)))))))))))))))cn6
|
[C][C][O][C][=N][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][#N][C][=N][Ring2][Ring1][#Branch1]
|
C4(=O)CCCCC#N.c16ncc7cn1.[C@H]19CCC[C@H]18.C39=O.CC5.O56.N37.N48
|
C#CCN(CC(=O)N1Cc2cc(O)nnc2C1)C(=O)CC1(N(C)C)CC1
|
C#CCNCC=O)NCcccO)nnc6C9)))))))))))C=O)CCNC)C))CC3
|
[C][#C][C][N][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][C][O][=N][N][=C][Ring1][#Branch1][C][Ring1][#Branch2][C][=Branch1][C][=O][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][C][Ring1][=Branch1]
|
N13Cc2cc(O)nnc2C1.C6C3=O.C4(=O)C8.C178CC1.C#CC5.N456.N7(C)C
|
CC=CC(=O)N[C@H](CC(=O)N[C@H]1C=CCCC1)C(F)F
|
CC=CC=O)N[C@H]CC=O)N[C@H]C=CCCC6)))))))))CF)F
|
[C][C][=C][C][=Branch1][C][=O][N][C@H1][Branch1][#C][C][C][=Branch1][C][=O][N][C@H1][C][=C][C][C][C][Ring1][=Branch1][C][Branch1][C][F][F]
|
[C@@H]4(CC3=O)C(F)F.[C@H]15C=CCCC1.C=6C2=O.CC=6.N24.N35
|
CC(C)C[C@@H](O)[C@H](C)C(=O)N(CC(=O)NCCc1nc[nH]n1)C(C)C
|
CCC)C[C@@H]O)[C@H]C)C=O)NCC=O)NCCcnc[nH]n5))))))))))CC)C
|
[C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][S][C][C][=Branch1][C][=O][N][C][C][C][N][=C][NH1][N][=Ring1][Branch1][C][Branch1][C][C][C]
|
CC(C)C[C@@H](O)[C@H](C)C2=O.c17nc[nH]n1.C4C3=O.N246.C5C7.C6(C)C.N35
|
C=CC[C@@H](CNC(=O)c1cn([C@@H]2CC[C@H]2O)nn1)NC(=O)c1nn(C)cc1SC
|
C=CC[C@@H]CNC=O)ccn[C@@H]CC[C@H]4O)))))nn5))))))))NC=O)cnnC)cc5SC
|
[C][=C][C][C@@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][Branch2][C@@H1][C][C][C@H1][Ring1][Ring2][O][N][=N][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][S][C]
|
c18nn(C)cc1%10.C=CC[C@H]5C6.c17cn9nn1.[C@@H]19CC[C@H]1O.C37=O.C48=O.N36.N45.S%10C
|
CN(CC(CO)(CO)NC(=O)[C@H]1Cc2ccccc21)C(=O)C=C1CCCCC1
|
CNCCCO))CO))NC=O)[C@H]Ccccccc68))))))))))))C=O)C=CCCCCC6
|
[C][N][Branch2][Ring1][N][C][C][Branch1][Ring1][C][O][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][C][C][C][C][Ring1][=Branch1]
|
C3(=O)[C@H]1Cc2ccccc21.C5C6(CO)CO.C1=7CCCCC1.C4(=O)C=7.CN45.N36
|
CCN(C(=O)c1ccc([N+](=O)[O-])o1)[C@H](C)CNC(=O)CCN1CCCC1=O
|
CCNC=O)cccc[N+]=O)[O-]))o5))))))[C@H]C)CNC=O)CCNCCCC5=O
|
[C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][O][Ring1][Branch2][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][N][C][C][C][C][Ring1][Branch1][=O]
|
c17ccc([N+](=O)[O-])o1.N18CCCC1=O.C3(=O)CC8.[C@@H]5(C)C6.N245.C27=O.CC4.N36
|
CN1CC(C(=O)N2CCCC(CN(C)C(=O)C(F)F)C2)CC1=O
|
CNCCC=O)NCCCCCNC)C=O)CF)F)))))C6)))))))CC5=O
|
[C][N][C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][C][Branch1][#C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][C][F][F][C][Ring1][=C][C][C][Ring2][Ring1][Branch1][=O]
|
CN1CC6CC1=O.N13CCCC7C1.C4(=O)C(F)F.C36=O.N45C.C57
|
C[C@@](O)(C(=O)N1C[C@H]2CC[C@@H](C1)N2C(=O)Cn1sc(=O)c2ccccc21)C1CC1
|
C[C@@]O)C=O)NC[C@H]CC[C@@H]C7)N5C=O)Cnsc=O)cccccc69)))))))))))))))))))CCC3
|
[C][C@@][Branch1][C][O][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][N][S][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][C][C][Ring1][Ring1]
|
n15sc(=O)c2ccccc21.N13C[C@H]2CC[C@@H](C1)N24.C[C@@]6(O)C3=O.C4(=O)C5.C16CC1
|
CC1(C)[C@H](CNC(=O)[C@@H](NC(=O)C=CCF)C2CC2)C1(F)F
|
CCC)[C@H]CNC=O)[C@@H]NC=O)C=CCF))))))CCC3)))))))C3F)F
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][#Branch2][N][C][=Branch1][C][=O][C][=C][C][F][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Ring1][Branch1][C][F][F]
|
CC1(C)[C@H]8C1(F)F.C3(=O)[C@@H]69.C4(=O)C=7.C=7CF.C19CC1.C58.N35.N46
|
CNC(=O)NCCC(=O)N[C@H]1CC[C@]12CCCN(C(=O)C[C@H]1C[C@@H]1C(F)(F)F)C2
|
CNC=O)NCCC=O)N[C@H]CC[C@]4CCCNC=O)C[C@H]C[C@@H]3CF)F)F)))))))C6
|
[C][N][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C@H1][C][C][C@][Ring1][Ring2][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C@H1][C][C@@H1][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][S]
|
[C@H]18CC[C@]12CCCN6C2.C7CC5=O.C6(=O)C9.[C@H]19C[C@@H]1%10.C%10(F)(F)F.C34=O.CN3.N47.N58
|
CC1(C)[C@@H](CNC(=O)C2(O)CCC2)CCN1C(=O)C[C@@H]1CCC(=O)C1
|
CCC)[C@@H]CNC=O)CO)CCC4)))))))CCN5C=O)C[C@@H]CCC=O)C5
|
[C][C][Branch1][C][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][Branch1][C][O][C][C][C][Ring1][Branch1][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][C@@H1][C][C][C][=Branch1][C][=O][C][Ring1][=Branch1]
|
CC1(C)[C@@H]7CCN14.[C@@H]18CCC(=O)C1.C16(O)CCC1.C4(=O)C8.C36=O.C57.N35
|
Cc1ccc(N)cc1C(=O)N1C[C@@H](O)[C@H](NC(=O)[C@H]2C[C@H](C(F)F)C2)C1
|
CccccN)cc6C=O)NC[C@@H]O)[C@H]NC=O)[C@H]C[C@H]CF)F))C4))))))C5
|
[C][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][C][C@H1][Branch1][=Branch1][C][Branch1][C][F][F][C][Ring1][#Branch1][C][Ring1][S]
|
Cc1ccc(N)cc17.N13C[C@@H]5[C@H](O)C1.[C@H]16C[C@H]8C1.C37=O.C46=O.C8(F)F.N45
|
CC1=C(CCN[C@H]2CCNC(=O)CC2)C(C)(C)CCC1
|
CC=CCCN[C@H]CCNC=O)CC7))))))))))CC)C)CCC6
|
[C][C][=C][Branch1][S][C][C][N][C@H1][C][C][N][C][=Branch1][C][=O][C][C][Ring1][Branch2][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][Ring1]
|
CC1=C(CC3)C(C)(C)CCC1.[C@H]14CCNC(=O)CC1.N34
|
CCC(=O)N[C@H](C)C(=O)N(C)C[C@H]1CCCN(c2c([N+](=O)[O-])cnn2C)C1
|
CCC=O)N[C@H]C)C=O)NC)C[C@H]CCCNcc[N+]=O)[O-]))cnn5C))))))C6
|
[C][C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][C][C][C][N][Branch1][S][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=N][N][Ring1][Branch2][C][C][Ring1][#C]
|
c17c([N+](=O)[O-])cnn1C.[C@H]18CCCN7C1.[C@@H]5(C)C4=O.CCC3=O.N46C.N35.C68
|
C#CCCC(=O)N1C[C@@H](NC(=O)C2([C@H]3CCCO3)CC2)CC12CCCCCC2
|
C#CCCC=O)NC[C@@H]NC=O)C[C@H]CCCO5)))))CC3)))))CC5CCCCCC7
|
[C][#C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][Branch1][Branch2][C@H1][C][C][C][O][Ring1][Branch1][C][C][Ring1][Branch2][C][C][Ring1][S][C][C][C][C][C][C][Ring1][#Branch1]
|
N14C[C@@H]6CC12CCCCCC2.C#CCCC4=O.[C@H]18CCCO1.C178CC1.C57=O.N56
|
C#CC[C@H](NC(=O)[C@@](C)(C1CC1)N(C)C(=O)C(C1CC1)C1CC1)C(N)=O
|
C#CC[C@H]NC=O)[C@@]C)CCC3)))NC)C=O)CCCC3)))CCC3)))))))))CN)=O
|
[C][#C][C][C@H1][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][C][Ring1][Ring1][C][Branch1][C][N][=O]
|
C#CC[C@H]4C(N)=O.C2(=O)[C@]56C.C3(=O)C78.C16CC1.N35C.C17CC1.C18CC1.N24
|
C=C[C@@H](CC)C(=O)N1C[C@H](NC(=O)CCCCSC)CC12CCCCC2
|
C=C[C@@H]CC))C=O)NC[C@H]NC=O)CCCCSC))))))))CC5CCCCC6
|
[C][=C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][N][N][C][=Branch1][C][=O][C][C][C][C][S][C][C][C][Ring1][=C][C][C][C][C][C][Ring1][=Branch1]
|
N13C[C@H]6CC12CCCCC2.C=C[C@@H](CC)C3=O.C4(=O)CCCC5.N46.S5C
|
C=C[C@@H](OC)C(=O)NC[C@@H]1CCCN(C(=O)c2ncc(C)cc2OC)C1
|
C=C[C@@H]OC))C=O)NC[C@@H]CCCNC=O)cnccC)cc6OC)))))))))C6
|
[C][=C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][O][C][C][Ring1][P]
|
c18ncc(C)cc16.[C@@H]19CCCN4C1.C=C[C@@H]5C3=O.C48=O.O5C.N37.C79.O6C
|
CCN(CCNC(=O)C[C@H]1COc2ccccc2O1)c1ccncc1C(=O)OC
|
CCNCCNC=O)C[C@H]COcccccc6O%10)))))))))))))))cccncc6C=O)OC
|
[C][C][N][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][C@H1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C]
|
[C@H]1%10COc2ccccc2O1.c18ccncc19.C4(=O)C%10.N568.C6C7.C39=O.CC5.N47.O3C
|
C[C@H](C(=O)N1CCC(N2CC[C@@H](NC(=O)C3(C)CC=CC3)C2)CC1)n1cccn1
|
C[C@H]C=O)NCCCNCC[C@@H]NC=O)CC)CC=CC5)))))))C5)))))CC6)))))))ncccn5
|
[C][C@H1][Branch2][Ring2][=Branch2][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch2][N][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=C][C][Ring1][=Branch1][C][Ring1][=C][C][C][Ring2][Ring1][Ring2][N][C][=C][C][=N][Ring1][Branch1]
|
N14CCC6CC1.N16CC[C@@H]7C1.C18(C)CC=CC1.C[C@@H]9C4=O.n19cccn1.C58=O.N57
|
CC[C@H](CNC(=O)c1ccnc(C)c1)NC(=O)c1c(Br)noc1C1CC1
|
CC[C@H]CNC=O)cccncC)c6)))))))))NC=O)ccBr)noc5CCC3
|
[C][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][Branch1][C][Br][=N][O][C][=Ring1][=Branch1][C][C][C][Ring1][Ring1]
|
c16ccnc(C)c1.c17c(Br)noc18.CC[C@@H]4C5.C26=O.C37=O.C18CC1.N25.N34
|
CC(=O)OC(C)(C)C(=O)N(C)C[C@@H](O)CN(C)C(=O)c1ccc(S(N)(=O)=O)nc1
|
CC=O)OCC)C)C=O)NC)C[C@@H]O)CNC)C=O)ccccSN)=O)=O))nc6
|
[C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][N][=C][Ring1][#Branch2]
|
c18ccc(S(N)(=O)=O)nc1.C5(C)(C)C3=O.C6[C@@H](O)C7.CC2=O.N36C.N47C.C48=O.O25
|
C=CCC1(NC(=O)C[C@@H]2CC[C@@H](O)C2)CN(C(=O)c2nc3nccc(C)n3n2)C1
|
C=CCCNC=O)C[C@@H]CC[C@@H]O)C5))))))))CNC=O)cncncccC)n6n9))))))))))C4
|
[C][=C][C][C][Branch1][P][N][C][=Branch1][C][=O][C][C@@H1][C][C][C@@H1][Branch1][C][O][C][Ring1][=Branch1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][N][=C][N][=C][C][=C][Branch1][C][C][N][Ring1][#Branch1][N][=Ring1][#Branch2][C][Ring2][Ring1][#Branch2]
|
c17nc2nccc(C)n2n1.C168CN5C1.[C@@H]19CC[C@@H](O)C1.C4(=O)C9.C=CC8.C57=O.N46
|
CCN1C[C@H](C(=O)N(Cc2scnc2C)C[C@H]2CCN(C(C)=O)C2)NC1=O
|
CCNC[C@H]C=O)NCcscnc5C)))))))C[C@H]CCNCC)=O))C5))))))))NC5=O
|
[C][C][N][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][S][C][=N][C][=Ring1][Branch1][C][C][C@H1][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][Ring1][Branch2][N][C][Ring2][Ring1][Branch2][=O]
|
N18C[C@H]7NC1=O.c19scnc1C.[C@H]1%10CCN4C1.C37=O.N356.C4(C)=O.CC8.C59.C6%10
|
CCC[C@H](C#N)C(=O)N[C@@H]1CN(C(=O)c2nn3c(c2C)CCCC3)C[C@H]1C
|
CCC[C@H]C#N))C=O)N[C@@H]CNC=O)cnncc5C))CCCC6)))))))))C[C@H]5C
|
[C][C][C][C@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=N][N][C][=Branch1][Branch1][=C][Ring1][Branch1][C][C][C][C][C][Ring1][Branch2][C][C@H1][Ring1][P][C]
|
c17nn2c(c1C)CCCC2.CCC[C@H](C#N)C4=O.[C@@H]16CN5C[C@H]1C.C57=O.N46
|
O=C(c1cnc2[nH]nnc2c1)N1CC[C@H]2CCN(C(=O)[C@H]3CCCO3)[C@H]2C1
|
O=Cccnc[nH]nnc5c9)))))))))NCC[C@H]CCNC=O)[C@H]CCCO5))))))[C@H]5C9
|
[O][=C][Branch1][=C][C][=C][N][=C][NH1][N][=N][C][Ring1][Branch1][=C][Ring1][=Branch2][N][C][C][C@H1][C][C][N][Branch1][N][C][=Branch1][C][=O][C@H1][C][C][C][O][Ring1][Branch1][C@H1][Ring1][N][C][Ring1][S]
|
N14CC[C@H]2CCN5[C@H]2C1.c17cnc2[nH]nnc2c1.[C@H]16CCCO1.O=C47.C56=O
|
C=C(C)C[C@@H](C)C(=O)NCCC1(O)CCN(C(=O)CCCCCNC(N)=O)CC1
|
C=CC)C[C@@H]C)C=O)NCCCO)CCNC=O)CCCCCNCN)=O)))))))))CC6
|
[C][=C][Branch1][C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][C][C][N][C][Branch1][C][N][=O][C][C][Ring2][Ring1][C]
|
C=C(C)C[C@@H](C)C2=O.C17(O)CCN3CC1.C3(=O)CCCCC6.C5C7.C4(N)=O.N25.N46
|
CCc1sccc1C(=O)N1CC[C@]2(CCCN(C(=O)c3cc(O)cc(=O)o3)C2)C1
|
CCcsccc5C=O)NCC[C@]CCCNC=O)cccO)cc=O)o6)))))))C6)))))C5
|
[C][C][C][S][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch2][Ring1][=N][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][=Branch1][C][=O][O][Ring1][Branch2][C][Ring1][S][C][Ring2][Ring1][Ring2]
|
N14CC[C@]2(CCCN5C2)C1.c16cc(O)cc(=O)o1.c18sccc17.C47=O.C56=O.CC8
|
COC1CC2(C1)CC(C(=O)N1C[C@H]3CC(NC(=O)CCC(F)F)C[C@@H]3C1)C2
|
COCCCC4)CCC=O)NC[C@H]CCNC=O)CCCF)F))))))C[C@@H]5C8)))))))))C4
|
[C][O][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][C][C][Branch1][=N][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][F][C][C@@H1][Ring1][=N][C][Ring1][S][C][Ring2][Ring1][#Branch1]
|
N14C[C@H]2CC7C[C@@H]2C1.C16CC2(C1)CC8C2.C5(=O)CCC(F)F.C48=O.CO6.N57
|
C[C@H](NC(=O)c1cccs1)C(=O)N[C@@H]1CN(C(=O)Cc2cscn2)CC[C@H]1CO
|
C[C@H]NC=O)ccccs5)))))))C=O)N[C@@H]CNC=O)Cccscn5)))))))CC[C@H]6CO
|
[C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][C][=N][Ring1][Branch1][C][C][C@H1][Ring1][=C][C][O]
|
[C@@H]17CN5CC[C@H]1%10.C[C@H]6C4=O.c18cccs1.c19cscn1.C5(=O)C9.C38=O.N36.N47.C%10O
|
CCN(C)CC(=O)N1CC[C@H]2CC[C@@]21CNC(=O)c1coc(-c2csc(C)n2)c1
|
CCNC)CC=O)NCC[C@H]CC[C@@]47CNC=O)ccoc-ccscC)n5)))))c5
|
[C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C@@][Ring1][Ring2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][O][C][Branch1][O][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][=C][Ring1][O]
|
N13CC[C@H]2CC[C@@]219.c18coc%10c1.c1%10csc(C)n1.C6C3=O.N56C.C48=O.CC5.C79.N47
|
CCc1occc1C(=O)N(C)C[C@@H](O)CN(C)C(=O)c1nnn(C)c1N
|
CCcoccc5C=O)NC)C[C@@H]O)CNC)C=O)cnnnC)c5N
|
[C][C][C][O][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C@@H1][Branch1][C][O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][=N][N][Branch1][C][C][C][=Ring1][=Branch1][N]
|
c16nnn(C)c1N.c18occc17.C4[C@@H](O)C5.C27=O.N24C.N35C.C36=O.CC8
|
CCN(C(=O)Cc1cnc(C2CC2)[nH]1)[C@H]1CCCN(C(=O)CCn2ccnc2)C1
|
CCNC=O)CccncCCC3)))[nH]5)))))))[C@H]CCCNC=O)CCnccnc5))))))))C6
|
[C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][=C][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][NH1][Ring1][Branch2][C@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][C][=C][N][=C][Ring1][Branch1][C][Ring1][#C]
|
[C@H]16CCCN4C1.c18cnc9[nH]1.C4(=O)CC7.n17ccnc1.C3(=O)C8.N356.C19CC1.CC5
|
COC[C@H](C)C(=O)N[C@@H](C)[C@@H]1CN(C(=O)c2ccc(C(=O)OC)c(F)c2)CCO1
|
COC[C@H]C)C=O)N[C@@H]C)[C@@H]CNC=O)ccccC=O)OC)))cF)c6)))))))CCO6
|
[C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@@H1][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Branch1][C][F][=C][Ring1][O][C][C][O][Ring2][Ring1][Ring1]
|
c18ccc9c(F)c1.[C@@H]1%10CN5CCO1.C6[C@H](C)C4=O.[C@@H]7%10C.C58=O.C39=O.CO6.N47.O3C
|
Cc1cc(=N[C@@H]2CCc3nc(C)ncc3C2)[nH]c(N2C[C@@H]3[C@H](C2)C3(F)F)n1
|
Cccc=N[C@@H]CCcncC)ncc6C%10)))))))))))[nH]cNC[C@@H][C@H]C5)C3F)F))))))n6
|
[C][C][=C][C][=Branch2][Ring1][Ring1][=N][C@@H1][C][C][C][=N][C][Branch1][C][C][=N][C][=C][Ring1][#Branch1][C][Ring1][O][NH1][C][Branch1][P][N][C][C@@H1][C@H1][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][Ring2][Branch1][C][F][F][=N][Ring2][Ring1][#Branch2]
|
Cc1cc(=N[C@@H]2CCc3nc(C)ncc3C2)[nH]c4n1.N14C[C@@H]2[C@H](C1)C2(F)F
|
COCC1(CC(=O)N2CCC[C@@H](NC(=O)C3=Cc4ccccc4[C@@H]3C)CC2)CC1
|
COCCCC=O)NCCC[C@@H]NC=O)C=Ccccccc6[C@@H]9C))))))))))))CC7)))))))))CC3
|
[C][O][C][C][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Ring1][=Branch2][C][C][C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][#Branch2]
|
C6(=O)C1=Cc2ccccc2[C@@H]1C.N15CCC[C@@H]8CC1.C19%10CC1.C%10C5=O.CO7.C79.N68
|
O=C(c1cnco1)N1C[C@@H]2C[C@@]2(CNCc2ccc([N+](=O)[O-])c(O)c2)C1
|
O=Cccnco5)))))NC[C@@H]C[C@@]3CNCcccc[N+]=O)[O-]))cO)c6)))))))))C6
|
[O][=C][Branch1][Branch2][C][=C][N][=C][O][Ring1][Branch1][N][C][C@@H1][C][C@@][Ring1][Ring1][Branch2][Ring1][=Branch1][C][N][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch1][C][O][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring1]
|
c18ccc([N+](=O)[O-])c(O)c1.N13C[C@@H]2C[C@@]27C1.c16cnco1.O=C36.C47.N45.C58
|
CC(C)(C)C#CC(=O)N(C1CCCCCC1)C1CC1
|
CCC)C)C#CC=O)NCCCCCCC7)))))))CCC3
|
[C][C][Branch1][C][C][Branch1][C][C][C][#C][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][#Branch1][C][C][C][Ring1][Ring1]
|
CC(C)(C)C#CC2=O.C13CCCCCC1.N234.C14CC1
|
C[C@H]1CCCC=C1C(=O)N1CC(F)(C(=O)NC[C@@H]2CC3(CCO2)CC3)C1
|
C[C@H]CCCC=C6C=O)NCCF)C=O)NC[C@@H]CCCCO6)))CC3))))))))C4
|
[C][C@H1][C][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][Branch1][=Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][=Branch1][C][Ring1][P]
|
C[C@H]1CCCC=C1C4=O.[C@@H]18CC2(CCO1)CC2.N14CC7(F)C1.C57=O.N56.C68
|
C[C@H](CC1CCC1)C(=O)NC[C@@H]1[C@H]2C[C@@H]1N(C(=O)CCc1cncnc1)C2
|
C[C@H]CCCCC4)))))C=O)NC[C@@H][C@H]C[C@@H]4NC=O)CCccncnc6)))))))))C5
|
[C][C@H1][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][C][=Branch1][C][=O][N][C][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][=C][N][=C][N][=C][Ring1][=Branch1][C][Ring1][#C]
|
[C@@H]17[C@H]2C[C@@H]1N4C2.C[C@H](C6)C3=O.c18cncnc1.C4(=O)CC8.C16CCC1.N35.C57
|
CC[C@](C)(OC)C(=O)N[C@@H]1CN(C(=O)Cc2cn[nH]c2)CC[C@@H]1C
|
CC[C@]C)OC))C=O)N[C@@H]CNC=O)Cccn[nH]c5)))))))CC[C@@H]6C
|
[C][C][C@][Branch1][C][C][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=N][NH1][C][=Ring1][Branch1][C][C][C@@H1][Ring1][=C][C]
|
[C@@H]16CN4CC[C@@H]1C.CC[C@@]5(C)C3=O.c17cn[nH]c1.C4(=O)C7.O5C.N36
|
CC(C)CO[C@H](C)C(=O)N1CCOC[C@@H]1CCNC(=O)[C@H]1COCCN1C=O
|
CCC)CO[C@H]C)C=O)NCCOC[C@@H]6CCNC=O)[C@H]COCCN6C=O
|
[C][C][Branch1][C][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@H1][C][O][C][C][N][Ring1][=Branch1][C][=O]
|
[C@H]17COCCN1C=O.N12CCOC[C@@H]18.[C@@H]5(C)C2=O.CC(C)C4.C8C6.C37=O.O45.N36
|
C=CC1(C(=O)NCC(F)(F)C(C)(C)O)CCN(C(=O)C=CC2CCOCC2)CC1
|
C=CCC=O)NCCF)F)CC)C)O))))))CCNC=O)C=CCCCOCC6)))))))))CC6
|
[C][=C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][C][Branch1][C][C][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][C][C][O][C][C][Ring1][=Branch1][C][C][Ring2][Ring1][O]
|
C=CC16CCN4CC1.C5C(F)(F)C(C)(C)O.C=7C1CCOCC1.C4(=O)C=7.C36=O.N35
|
CN(CC1CCCCC1)C(=O)[C@H]1CN(C(=O)[C@]2(O)CCOC2(C)C)CCC1(C)C
|
CNCCCCCCC6)))))))C=O)[C@H]CNC=O)[C@]O)CCOC5C)C)))))))CCC6C)C
|
[C][N][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@][Branch1][C][O][C][C][O][C][Ring1][=Branch1][Branch1][C][C][C][C][C][C][Ring1][S][Branch1][C][C][C]
|
[C@H]16CN4CCC1(C)C.[C@@]17(O)CCOC1(C)C.C18CCCCC1.CN35.C36=O.C47=O.C58
|
Cc1ccc(C(=O)N2CC[C@@H]([C@H](C)C(=O)N3CCC=C(F)C3)C2)nc1O
|
CccccC=O)NCC[C@@H][C@H]C)C=O)NCCC=CF)C6))))))))C5))))))nc6O
|
[C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring2][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][=C][Branch1][C][F][C][Ring1][#Branch1][C][Ring1][S][N][=C][Ring2][Ring1][Branch2][O]
|
Cc1ccc6nc1O.N15CCC=C(F)C1.N14CC[C@@H]7C1.[C@@H]7(C)C5=O.C46=O
|
C#CC[C@H](CC(=O)N1CC2(CC2)C1)NC(=O)c1c(C)ccnc1C
|
C#CC[C@H]CC=O)NCCCC3))C4))))))NC=O)ccC)ccnc6C
|
[C][#C][C][C@H1][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][N][=C][Ring1][#Branch1][C]
|
C#CC[C@@H]5CC3=O.c16c(C)ccnc1C.N13CC2(CC2)C1.C46=O.N45
|
Cc1cnc(C(=O)NCc2csc(CNC(=O)[C@H]3COC(=O)C3)n2)cc1Cl
|
CccncC=O)NCccscCNC=O)[C@H]COC=O)C5))))))))n5))))))))cc6Cl
|
[C][C][=C][N][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][=C][S][C][Branch1][P][C][N][C][=Branch1][C][=O][C@H1][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][=N][Ring1][#C][C][=C][Ring2][Ring1][=Branch2][Cl]
|
Cc1cnc8cc1Cl.c1%10csc%11n1.[C@H]19COC(=O)C1.C48=O.C59=O.N46.C6%10.C7%11.N57
|
O=C(C[C@H]1CC1(Cl)Cl)N1C[C@H]2CC[C@@H](C1)N2C(=O)C#CC1CCCCC1
|
O=CC[C@H]CC3Cl)Cl)))))NC[C@H]CC[C@@H]C7)N5C=O)C#CCCCCCC6
|
[O][=C][Branch1][O][C][C@H1][C][C][Ring1][Ring1][Branch1][C][Cl][Cl][N][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][#C][C][C][C][C][C][C][Ring1][=Branch1]
|
C4(=O)C#CC1CCCCC1.N13C[C@H]2CC[C@@H](C1)N24.[C@H]15CC1(Cl)Cl.O=C3C5
|
CC1(C(=O)NC[C@@H]2N(C(=O)CCNC(=O)C3CCC3)CCC2(C)C)CC(F)(F)C1
|
CCC=O)NC[C@@H]NC=O)CCNC=O)CCCC4)))))))))CCC5C)C)))))))))CCF)F)C4
|
[C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][C][Ring1][S][Branch1][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring2][Ring1][N]
|
[C@@H]1%11N5CCC1(C)C.CC19CC(F)(F)C1.C5(=O)CC8.C1%10CCC1.C49=O.C6%10=O.N47.C7%11.N68
|
CCOc1cnc(C(=O)N2C[C@@H](N(C)C(=O)Cc3ccsn3)C3(CC3)C2)c(Cl)c1
|
CCOccncC=O)NC[C@@H]NC)C=O)Ccccsn5))))))))CCC3))C5))))))cCl)c6
|
[C][C][O][C][=C][N][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][P][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][S][N][=Ring1][Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][P][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch2]
|
c17cnc9c(Cl)c1.N14C[C@@H]8C2(CC2)C1.c1%10ccsn1.C5(=O)C%10.C49=O.N58C.CC6.O67
|
Cc1cccc([C@H](O)C(=O)OCCc2ccccc2Cl)c1F
|
Cccccc[C@H]O)C=O)OCCcccccc6Cl))))))))))))c6F
|
[C][C][=C][C][=C][C][Branch2][Ring1][Branch1][C@H1][Branch1][C][O][C][=Branch1][C][=O][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=C][Ring2][Ring1][Ring2][F]
|
Cc1cccc5c1F.c16ccccc1Cl.[C@@H]5(O)C3=O.C4C6.O34
|
CC(Cl)(Cl)C(=O)N[C@@H]1CN(C(=O)[C@@H]2CCCC[C@H]2O)C[C@H]1c1cccc(F)c1
|
CCCl)Cl)C=O)N[C@@H]CNC=O)[C@@H]CCCC[C@H]6O))))))))C[C@H]5cccccF)c6
|
[C][C][Branch1][C][Cl][Branch1][C][Cl][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C@@H1][C][C][C][C][C@H1][Ring1][=Branch1][O][C][C@H1][Ring1][=C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
[C@@H]15CN4C[C@H]17.[C@@H]16CCCC[C@H]1O.c17cccc(F)c1.CC(Cl)(Cl)C3=O.C46=O.N35
|
C=C1CC(C(=O)N[C@@H]2[C@H]3C[C@H]4CN(C(=O)C(=O)Nc5ccc(C)cc5)[C@H]2[C@H]4C3)C1
|
C=CCCC=O)N[C@@H][C@H]C[C@H]CNC=O)C=O)NccccC)cc6)))))))))[C@H]7[C@H]5C8)))))))))))C4
|
[C][=C][C][C][Branch2][Ring2][=C][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C@H1][Ring2][Ring1][Ring1][C@H1][Ring1][P][C][Ring2][Ring1][Ring2][C][Ring2][Ring1][N]
|
[C@@H]1%10[C@H]2C[C@H]3CN7[C@H]1[C@H]3C2.c19ccc(C)cc1.C=C1CC%11C1.C7(=O)C8=O.C6%11=O.N6%10.N89
|
Cc1nn(CC(=O)NCCNC(=O)C2(C)CCC2)c(C)c1Br
|
CcnnCC=O)NCCNC=O)CC)CCC4)))))))))))cC)c5Br
|
[C][C][=N][N][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][=C][Ring2][Ring1][Ring2][Br]
|
Cc1nn8c(C)c1Br.C17(C)CCC1.C8C3=O.C5C6.C47=O.N35.N46
|
Cc1c(Cl)cnn1CC(=O)NCC12CCC(NC(=O)c3ncn(C)n3)(CC1)CO2
|
CccCl)cnn5CC=O)NCCCCCNC=O)cncnC)n5)))))))CC6))CO6
|
[C][C][=C][Branch1][C][Cl][C][=N][N][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C][N][=C][N][Branch1][C][C][N][=Ring1][=Branch1][Branch1][Branch1][C][C][Ring1][#C][C][O][Ring1][P]
|
C12%10CCC7(CC1)CO2.Cc1c(Cl)cnn19.c18ncn(C)n1.C9C4=O.C58=O.N46.C6%10.N57
|
CN(C)CCn1nccc1C(=O)N1CC[C@@H](OCCNC(=O)c2ncn(C)n2)C1
|
CNC)CCnnccc5C=O)NCC[C@@H]OCCNC=O)cncnC)n5))))))))))C5
|
[C][N][Branch1][C][C][C][C][N][N][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][O][C][C][N][C][=Branch1][C][=O][C][N][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][Ring1][P]
|
n1%11nccc19.N13CC[C@@H]6C1.c1%10ncn(C)n1.CN7C.C7C%11.C39=O.C5C8.C4%10=O.O56.N48
|
CC(=O)N1CCC[C@@H]1CC(=O)N[C@H]1C[C@@H](NC(=O)[C@@H]2CCCC2(F)F)C1
|
CC=O)NCCC[C@@H]5CC=O)N[C@H]C[C@@H]NC=O)[C@@H]CCCC5F)F))))))))C4
|
[C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][Ring1][Branch1][Branch1][C][F][F][C][Ring1][=C]
|
[C@@H]18CCCC1(F)F.N13CCC[C@@H]19.[C@H]16C[C@@H]7C1.C9C4=O.CC3=O.C58=O.N46.N57
|
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