SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
C[C@@H](CCCNC(=O)c1cc(-c2cnn(C)c2)on1)NC(=O)C=C[S@@+](C)[O-]
|
C[C@@H]CCCNC=O)ccc-ccnnC)c5)))))on5))))))))))NC=O)C=C[S@@+]C)[O-]
|
[C][C@@H1][Branch2][Ring1][N][C][C][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][O][N][=Ring1][O][N][C][=Branch1][C][=O][C][=C][S@@+1][Branch1][C][C][O-1]
|
C4(=O)C=C[S@@+](C)[O-].C[C@H]5CCC6.c17cc8on1.c18cnn(C)c1.C37=O.N36.N45
|
C=C[C@](C)(O)CC(=O)N1CC[C@@H](CN(C)C(=O)c2ccccc2OCCC)C1
|
C=C[C@]C)O)CC=O)NCC[C@@H]CNC)C=O)cccccc6OCCC)))))))))))))C5
|
[C][=C][C@][Branch1][C][C][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][C][Ring2][Ring1][Ring2]
|
C=C[C@](C)(O)CC3=O.c18ccccc16.N13CC[C@@H]9C1.N47C.C48=O.C5CC.C79.O56
|
CC(C)OCC(=O)N1C[C@H](CNC(=O)[C@@H](CO)c2ccccc2)[C@@H](N(C)C)C1
|
CCC)OCC=O)NC[C@H]CNC=O)[C@@H]CO))cccccc6))))))))))[C@@H]NC)C))C5
|
[C][C][Branch1][C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring2][Ring1][Branch1]
|
N13C[C@H]8[C@@H]9C1.C4(=O)[C@H]%10CO.c1%10ccccc1.C6C3=O.CC5C.N8(C)C.O56.C79.N47
|
CCn1cc([N+](=O)[O-])c(C(=O)NCC[C@@H](C)N(C)C(=O)C[C@H]2CC3(CC3)CO2)n1
|
CCncc[N+]=O)[O-]))cC=O)NCC[C@@H]C)NC)C=O)C[C@H]CCCC3))CO5)))))))))))))n5
|
[C][C][N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C@H1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][O][Ring1][#Branch1][=N][Ring2][Ring1][O]
|
n19cc([N+](=O)[O-])c8n1.[C@H]1%10CC2(CC2)CO1.C6C[C@H]7C.C5(=O)C%10.C48=O.N57C.CC9.N46
|
CC[C@@H]1CCCCN1C(=O)[C@@H]1[C@H]2C[C@@H]1N(C(=O)c1nccs1)C2
|
CC[C@@H]CCCCN6C=O)[C@@H][C@H]C[C@@H]4NC=O)cnccs5))))))C5
|
[C][C][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch1][N][C][=Branch1][C][=O][C][=N][C][=C][S][Ring1][Branch1][C][Ring1][N]
|
[C@@H]17CCCCN13.[C@@H]16[C@H]2C[C@@H]1N4C2.c15nccs1.C36=O.C45=O.CC7
|
CC1=C(C(=O)N2C[C@@H]3COCC[C@@]3(NC(=O)c3cnc(S)[nH]3)C2)SCCO1
|
CC=CC=O)NC[C@@H]COCC[C@@]6NC=O)ccncS)[nH]5)))))))C9))))))))))SCCO6
|
[C][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][C][C@@][Ring1][=Branch1][Branch1][S][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][S][NH1][Ring1][=Branch1][C][Ring2][Ring1][C][S][C][C][O][Ring2][Ring1][#Branch2]
|
N14C[C@@H]2COCC[C@@]26C1.CC1=C(C4=O)SCCO1.c17cnc(S)[nH]1.C57=O.N56
|
COC(=O)[C@@H]1[C@H](C)CCN1[C@@H](C(=O)N[C@H]1CCOC1)c1cc(Cl)ccn1
|
COC=O)[C@@H][C@H]C)CCN5[C@@H]C=O)N[C@H]CCOC5)))))))cccCl)ccn6
|
[C][O][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][C][C][C][C][N][Ring1][=Branch1][C@@H1][Branch1][=N][C][=Branch1][C][=O][N][C@H1][C][C][O][C][Ring1][Branch1][C][=C][C][Branch1][C][Cl][=C][C][=N][Ring1][#Branch1]
|
[C@@H]16[C@H](C)CCN14.c17cc(Cl)ccn1.[C@@H]47C3=O.[C@H]15CCOC1.C26=O.CO2.N35
|
Cc1cncc(CC(=O)N(C)C(C)(C)CC(=O)N(C)CCCN=[N+]=[N-])c1
|
CccnccCC=O)NC)CC)C)CC=O)NC)CCCN=[N+]=[N-])))))))))))))c6
|
[C][C][=C][N][=C][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][=N+1][=N-1][=C][Ring2][Ring1][=Branch2]
|
Cc1cncc6c1.C4(C)(C)CC3=O.C5CCN=[N+]=[N-].C6C2=O.N24C.N35C
|
Cc1ncnc(N2CC[C@H](CNC(=O)C3(C)C[C@H]4CC[C@@H](C3)S4)C23CC3)c1F
|
CcncncNCC[C@H]CNC=O)CC)C[C@H]CC[C@@H]C7)S5))))))))))C5CC3)))))))c6F
|
[C][C][=N][C][=N][C][Branch2][Ring2][#Branch1][N][C][C][C@H1][Branch2][Ring1][Branch2][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][C][C][C][Ring1][Ring1][=C][Ring2][Ring1][#Branch2][F]
|
C18(C)C[C@H]2CC[C@@H](C1)S2.Cc1ncnc7c1F.N17CC[C@H]9C12CC2.C58=O.C69.N56
|
CC(C)CSCCC(=O)NC[C@H](NC(=O)[C@H](C)Oc1ccccc1F)C1CCC1
|
CCC)CSCCC=O)NC[C@H]NC=O)[C@H]C)Occcccc6F)))))))))))CCCC4
|
[C][C][Branch1][C][C][C][S][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][C][C][Ring1][Ring2]
|
c15ccccc1F.C9CC2=O.C3(=O)[C@@H]4C.CC(C)C8.C6[C@H]7%10.C1%10CCC1.S89.N26.N37.O45
|
N#Cc1cc[nH]c(=NCCNC(=O)CCCOc2ccccc2)c1[N+](=O)[O-]
|
N#Cccc[nH]c=NCCNC=O)CCCOcccccc6)))))))))))))))c6[N+]=O)[O-]
|
[N][#C][C][C][=C][NH1][C][=Branch2][Ring1][Branch1][=N][C][C][N][C][=Branch1][C][=O][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring2][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1]
|
N#Cc1cc[nH]c(=NCC6)c1[N+](=O)[O-].C3(=O)CCC4.c15ccccc1.N36.O45
|
NC(=O)N1CCC(NC(=O)[C@H](F)[C@H]2CCN(C(=O)c3cc(O)cs3)C2)CC1
|
NC=O)NCCCNC=O)[C@H]F)[C@H]CCNC=O)cccO)cs5))))))C5))))))))CC6
|
[N][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@H1][Branch1][C][F][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][S][Ring1][=Branch1][C][Ring1][=N][C][C][Ring2][Ring1][Branch2]
|
N14CCC7CC1.[C@H]19CCN6C1.c18cc(O)cs1.C5(=O)[C@@H]9F.NC4=O.C68=O.N57
|
C[C@H]1C[C@@H](C(=O)N2CC(CNC(=O)C(C)(C)CC3CCOCC3)C2)CO1
|
C[C@H]C[C@@H]C=O)NCCCNC=O)CC)C)CCCCOCC6)))))))))))C4)))))CO5
|
[C][C@H1][C][C@@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][C][C][O][Ring2][Ring1][=Branch2]
|
C5(=O)C(C)(C)C9.C[C@H]1C[C@@H]7CO1.C19CCOCC1.N14CC8C1.C47=O.C68.N56
|
CCC[C@@H](O)CC(=O)N[C@@H]1CCCN(C(=O)C=Cc2ccccn2)C1
|
CCC[C@@H]O)CC=O)N[C@@H]CCCNC=O)C=Ccccccn6)))))))))C6
|
[C][C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][S]
|
CCC[C@@H](O)CC3=O.[C@@H]15CCCN4C1.C=6c1ccccn1.C4(=O)C=6.N35
|
COC(C)(C)C(=O)NC/C=C(\C)C(=O)N1CC[C@H](C(F)(F)F)C1
|
COCC)C)C=O)NC/C=C\C)C=O)NCC[C@H]CF)F)F))C5
|
[C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=Branch2]
|
C4(C)(C)C2=O.N13CC[C@H]7C1.C=6(C)C3=O.C7(F)(F)F.C5C=6.CO4.N25
|
CNC(=O)CCOc1ccc(NC(=O)N[C@H]2C[C@H](OC(C)(C)C)C2)cc1
|
CNC=O)CCOccccNC=O)N[C@H]C[C@H]OCC)C)C)))C4)))))))cc6
|
[C][N][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring1]
|
c19ccc%10cc1.C3(=O)CC6.[C@H]1%11C[C@H]8C1.C7(C)(C)C.C45=O.CN3.O69.N4%10.N5%11.O78
|
C#CCCN1CCN([C@H](C(=O)NC2CC2)[C@@H]2CCC[C@@H](CC(F)(F)F)C2)CC1
|
C#CCCNCCN[C@H]C=O)NCCC3)))))[C@@H]CCC[C@@H]CCF)F)F)))C6)))))))CC6
|
[C][#C][C][C][N][C][C][N][Branch2][Ring1][P][C@H1][Branch1][O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C@@H1][C][C][C][C@@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][O][C][C][Ring2][Ring1][Branch2]
|
N14CCN5CC1.[C@@H]17CCC[C@@H]8C1.[C@H]57C3=O.C8C(F)(F)F.C#CCC4.C16CC1.N36
|
C#CCC1(C(=O)N[C@H](CC)CCCC(=O)NC[C@](C)(O)CCC)CCCC1
|
C#CCCC=O)N[C@H]CC))CCCC=O)NC[C@]C)O)CCC)))))))))))))CCCC5
|
[C][#C][C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][C][O][C][C][C][C][C][C][C][Ring2][Ring1][Branch2]
|
[C@@H]4(CC)CCCC3=O.C5[C@](C)(O)CCC.C167CCCC1.C#CC7.C26=O.N24.N35
|
CC(C)=C(C)C(=O)N1CCN(C(=O)[C@@H]2CCC(=O)[C@H](C)C2(C)C)C[C@@H]1C
|
CCC)=CC)C=O)NCCNC=O)[C@@H]CCC=O)[C@H]C)C6C)C))))))))C[C@@H]6C
|
[C][C][Branch1][C][C][=C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][Ring1][Branch2][Branch1][C][C][C][C][C@@H1][Ring2][Ring1][C][C]
|
[C@@H]15CCC(=O)[C@H](C)C1(C)C.N13CCN4C[C@@H]1C.C=6(C)C3=O.CC=6C.C45=O
|
CC[C@H](CC(F)(F)F)NC1(c2nnnn2CC)CC2(COC(=O)N2)C1
|
CC[C@H]CCF)F)F)))NCcnnnn5CC)))))))CCCOC=O)N5))))C4
|
[C][C][C@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][C][Branch1][#Branch2][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C][Branch1][#Branch2][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][Ring1][S]
|
C146CC2(COC(=O)N2)C1.CC[C@@H]3CC(F)(F)F.c16nnnn15.N34.C5C
|
CN1C[C@@H](CC(=O)N2CC=C(CNC(=O)CNC(=O)C3CCC3)CC2)[C@H](O)C1
|
CNC[C@@H]CC=O)NCC=CCNC=O)CNC=O)CCCC4))))))))))CC6))))))))[C@H]O)C5
|
[C][N][C][C@@H1][Branch2][Ring2][Ring2][C][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][Ring2][Ring1][C][C@H1][Branch1][C][O][C][Ring2][Ring1][O]
|
N14CC=C(C7)CC1.CN1C[C@@H]%10[C@H](O)C1.C%10C4=O.C5(=O)C8.C19CCC1.C69=O.N57.N68
|
Cc1cc(C(=O)N(C)C[C@]2(O)CCN(C(=O)CS(=O)(=O)C(C)C)C2)nn1C1CC1
|
CcccC=O)NC)C[C@]O)CCNC=O)CS=O)=O)CC)C)))))C5))))))))nn5CCC3
|
[C][C][=C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C@][Branch1][C][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][C][C][C][Ring1][#C][=N][N][Ring2][Ring1][=Branch2][C][C][C][Ring1][Ring1]
|
C4(=O)CS(=O)(=O)C(C)C.Cc1cc6nn18.[C@@]17(O)CCN4C1.C36=O.N35C.C18CC1.C57
|
COC(=O)[C@@H]1[C@H](C)CCN1C(=O)[C@H](O)C1CN(C(=O)Cc2cc(C)on2)C1
|
COC=O)[C@@H][C@H]C)CCN5C=O)[C@H]O)CCNC=O)CcccC)on5)))))))C4
|
[C][O][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][=C][Branch1][C][C][O][N][=Ring1][=Branch1][C][Ring1][=N]
|
[C@@H]16[C@H](C)CCN14.c17cc(C)on1.C4(=O)[C@@H]8O.C18CN5C1.C5(=O)C7.C36=O.CO3
|
CCc1ccc(C(=O)NC[C@@H]2CC[C@H]2NC(=O)[C@@H](C)c2ccccc2F)[nH]1
|
CCccccC=O)NC[C@@H]CC[C@H]4NC=O)[C@@H]C)cccccc6F)))))))))))))))))[nH]5
|
[C][C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][NH1][Ring2][Ring1][=Branch2]
|
c1%10ccccc1F.c18ccc7[nH]1.[C@@H]19CC[C@H]16.C4(=O)[C@H]%10C.C37=O.CC8.N35.C59.N46
|
CNc1cnc(C(C)C)nc1C(=O)NC1(CNC(=O)c2cc3n(n2)CCO3)CC1
|
CNccncCC)C))nc6C=O)NCCNC=O)cccnn5)CCO5))))))))))CC3
|
[C][N][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][N][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][O][Ring1][=Branch1][C][C][Ring1][#C]
|
c18cnc%11nc19.c1%10cc2n(n1)CCO2.C16%12CC1.C%11(C)C.C49=O.C5%10=O.CN8.N46.C7%12.N57
|
CCC[C@H]1C[C@@H]1C(=O)NCc1ccnc(C(=O)N[C@H]2CCNC2=O)c1
|
CCC[C@H]C[C@@H]3C=O)NCcccncC=O)N[C@H]CCNC5=O))))))))c6
|
[C][C][C][C@H1][C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=N][C][Branch1][=C][C][=Branch1][C][=O][N][C@H1][C][C][N][C][Ring1][Branch1][=O][=C][Ring1][#C]
|
c1%10ccnc7c1.[C@H]16CCNC1=O.[C@H]19C[C@@H]18.CCC9.C38=O.C47=O.N35.C5%10.N46
|
CC[C@@](C)(CCNC(=O)c1nccc(Cl)c1F)NC(=O)CCCSC
|
CC[C@@]C)CCNC=O)cncccCl)c6F)))))))))))NC=O)CCCSC
|
[C][C][C@@][Branch1][C][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][N][C][=Branch1][C][=O][C][C][C][S][C]
|
c17nccc(Cl)c1F.CC[C@@]4(C)CC5.C3(=O)CCC6.C27=O.N25.N34.S6C
|
O=C(CCc1ccco1)NNS(=O)(=O)c1ccc2c(c1)OCCO2
|
O=CCCcccco5)))))))NNS=O)=O)cccccc6)OCCO6
|
[O][=C][Branch1][#Branch2][C][C][C][=C][C][=C][O][Ring1][Branch1][N][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1]
|
O=C(CC3)NNS(=O)(=O)c1ccc2c(c1)OCCO2.c13ccco1
|
CN(CC1CC1)C(=O)[C@H]1CNC(=O)C12CCN(C(=O)c1nc[nH]n1)CC2
|
CNCCCC3))))C=O)[C@H]CNC=O)C5CCNC=O)cnc[nH]n5))))))CC6
|
[C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][C][Ring1][=Branch1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][N][=C][NH1][N][=Ring1][Branch1][C][C][Ring1][=N]
|
[C@H]17CNC(=O)C12CCN4CC2.c16nc[nH]n1.CN35.C18CC1.C37=O.C46=O.C58
|
CCNC(=O)C(=O)NC(C)(C)[C@@H]1CCN(C(=O)c2ncoc2C2CCCCC2)C1
|
CCNC=O)C=O)NCC)C)[C@@H]CCNC=O)cncoc5CCCCCC6))))))))))))C5
|
[C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][N][=C][O][C][=Ring1][Branch1][C][C][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][C]
|
[C@@H]19CCN5C1.c18ncoc1%10.C1%10CCCCC1.C3(=O)C4=O.C79(C)C.C58=O.CC6.N36.N47
|
C#CC[C@H](CC(F)F)C(=O)NC[C@@H]1CCC[C@H]1NC(=O)CN1CCC(F)(F)C1
|
C#CC[C@H]CCF)F)))C=O)NC[C@@H]CCC[C@H]5NC=O)CNCCCF)F)C5
|
[C][#C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1]
|
C#CC[C@H](CC(F)F)C2=O.N15CCC(F)(F)C1.[C@@H]17CCC[C@H]16.C3(=O)C5.N24.C47.N36
|
CC[C@@H](NC(=O)c1sccc1CNC(=O)[C@@H](O)C(F)(F)F)c1ncc(C)[nH]1
|
CC[C@@H]NC=O)csccc5CNC=O)[C@@H]O)CF)F)F)))))))))))))cnccC)[nH]5
|
[C][C][C@@H1][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F][C][=N][C][=C][Branch1][C][C][NH1][Ring1][=Branch1]
|
C3(=O)[C@@H](O)C(F)(F)F.c16sccc18.c17ncc(C)[nH]1.CC[C@@H]47.C26=O.N24.C58.N35
|
CC[C@@H](C)CCC(=O)N1CCCN(CCNC(=O)[C@@H](C)c2cncs2)CC1
|
CC[C@@H]C)CCC=O)NCCCNCCNC=O)[C@@H]C)ccncs5))))))))))CC7
|
[C][C][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][N][=C][S][Ring1][Branch1][C][C][Ring2][Ring1][Ring1]
|
CC[C@@H](C)CCC3=O.N13CCCN5CC1.C4(=O)[C@H]7C.c17cncs1.C5C6.N46
|
COCCO[C@@H](C)C(=O)NC1(C(=O)N2CC[C@@]3(CCCOC3)C2)CC(CO)C1
|
COCCO[C@@H]C)C=O)NCC=O)NCC[C@@]CCCOC6)))))C5))))))CCCO))C4
|
[C][O][C][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@@][Branch1][Branch2][C][C][C][O][C][Ring1][=Branch1][C][Ring1][#Branch2][C][C][Branch1][Ring1][C][O][C][Ring2][Ring1][C]
|
N15CC[C@@]2(CCCOC2)C1.C19%10CC%11C1.[C@H]8(C)C4=O.C6C7.C5%10=O.CO6.O78.N49.C%11O
|
CCN(C)Cc1cn(CCCC(=O)NC[C@]2(CO)C[C@H]3C[C@H]3C2)nn1
|
CCNC)CccnCCCC=O)NC[C@]CO))C[C@H]C[C@H]3C6))))))))))))nn5
|
[C][C][N][Branch1][C][C][C][C][=C][N][Branch2][Ring1][Branch2][C][C][C][C][=Branch1][C][=O][N][C][C@][Branch1][Ring1][C][O][C][C@H1][C][C@H1][Ring1][Ring1][C][Ring1][Branch2][N][=N][Ring2][Ring1][Ring2]
|
[C@@]1%10%11C[C@H]2C[C@H]2C1.c19cn8nn1.C8CCC4=O.N56C.CC5.C69.N47.C7%10.C%11O
|
COc1ccc(C(=O)N[C@H]2COCCN(C(=O)CCCS(N)(=O)=O)C2)cc1C
|
COccccC=O)N[C@H]COCCNC=O)CCCSN)=O)=O))))))C7)))))))))cc6C
|
[C][O][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][C][O][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][Ring1][S][C][=C][Ring2][Ring1][=Branch2][C]
|
C4(=O)CCCS(N)(=O)=O.c15ccc7cc1C.[C@H]16COCCN4C1.C37=O.CO5.N36
|
O=C(CO)N[C@@H]1C[C@H]2C[C@@H]1CN(C(=O)CN1CCC[C@H](OCC(F)F)C1)C2
|
O=CCO))N[C@@H]C[C@H]C[C@@H]5CNC=O)CNCCC[C@H]OCCF)F))))C6))))))))C6
|
[O][=C][Branch1][Ring1][C][O][N][C@@H1][C][C@H1][C][C@@H1][Ring1][Branch1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][N][C][C][C][C@H1][Branch1][Branch2][O][C][C][Branch1][C][F][F][C][Ring1][O][C][Ring2][Ring1][Ring2]
|
[C@@H]18C[C@H]2C[C@@H]1CN4C2.N17CCC[C@H]6C1.O=C3CO.C4(=O)C7.C5C(F)F.N38.O56
|
C#CCCCOCC(=O)NC[C@@]1(O)CCN(C(=O)[C@@H]2COCC(=O)N2C(C)C)C1
|
C#CCCCOCC=O)NC[C@@]O)CCNC=O)[C@@H]COCC=O)N6CC)C)))))))))C5
|
[C][#C][C][C][C][O][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][O][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][O][C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][C]
|
[C@@H]18COCC(=O)N19.[C@]1%10(O)CCN4C1.C#CCCC5.C6C3=O.C48=O.C9(C)C.O56.N37.C7%10
|
CCC=CC=CC(=O)N1C[C@H](CNC(=O)[C@H](C)CCO)[C@H](C(F)(F)F)C1
|
CCC=CC=CC=O)NC[C@H]CNC=O)[C@H]C)CCO)))))))[C@H]CF)F)F))C5
|
[C][C][C][=C][C][=C][C][=Branch1][C][=O][N][C][C@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][O][C@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][C]
|
N12C[C@@H]8[C@@H]7C1.C3(=O)[C@H](C)CCO.C=6C2=O.C8(F)(F)F.CCC=5.C=5C=6.C47.N34
|
CO[C@@H](C(=O)N1CC2(CCCO2)C1)C1CN(C(=O)[C@@H](O)c2ccccc2)C1
|
CO[C@@H]C=O)NCCCCCO5))))C4)))))CCNC=O)[C@@H]O)cccccc6))))))))C4
|
[C][O][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][#Branch1][C][C][C][O][Ring1][Branch1][C][Ring1][Branch2][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C]
|
N13CC2(CCCO2)C1.c17ccccc1.[C@@H]56C3=O.C16CN4C1.C4(=O)[C@H]7O.CO5
|
Cc1[nH]nc2c(C(=O)N[C@@H]3CN(C(=O)c4csnn4)[C@H]4CCCC[C@@H]34)cccc12
|
Cc[nH]nccC=O)N[C@@H]CNC=O)ccsnn5))))))[C@H]CCCC[C@@H]96)))))))))))cccc96
|
[C][C][NH1][N][=C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][S][N][=N][Ring1][Branch1][C@H1][C][C][C][C][C@@H1][Ring1][S][Ring1][=Branch1][=C][C][=C][C][=Ring2][Ring1][N][Ring2][Ring1][=Branch2]
|
Cc1[nH]nc2c9cccc12.[C@@H]17CN6[C@H]2CCCC[C@@H]12.c18csnn1.C59=O.C68=O.N57
|
Cn1ccc2c(C(=O)N3CC(NC(=O)c4cccc(CO)n4)C3)ncnc21
|
CnccccC=O)NCCNC=O)cccccCO))n6))))))))C4)))))ncnc69
|
[C][N][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][O][=N][Ring1][Branch2][C][Ring1][#C][N][=C][N][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][#Branch2]
|
Cn1ccc2c8ncnc21.c19cccc%10n1.N15CC7C1.C58=O.C69=O.N67.C%10O
|
CC[C@H]1C[C@@H]1CC(=O)N[C@@H]1C[C@H](O)[C@H]1CC(=O)N1CC(C)(C)CC[C@H]1C
|
CC[C@H]C[C@@H]3CC=O)N[C@@H]C[C@H]O)[C@H]4CC=O)NCCC)C)CC[C@H]6C
|
[C][C][C@H1][C][C@@H1][Ring1][Ring1][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][C][C][Branch1][C][C][C][C][C@H1][Ring1][Branch2][C]
|
N13CC(C)(C)CC[C@H]1C.[C@@H]14C[C@H](O)[C@H]17.[C@H]15C[C@@H]16.C6C2=O.C7C3=O.CC5.N24
|
Cn1cc(C(=O)N2C[C@H](CNC(=O)c3cncc(F)c3)CC(C)(C)C2)n(C)c1=O
|
CnccC=O)NC[C@H]CNC=O)ccnccF)c6)))))))))CCC)C)C6)))))))nC)c5=O
|
[C][N][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][Ring1][N][Branch1][C][C][C][Ring2][Ring1][O][=O]
|
N14C[C@H]9CC(C)(C)C1.Cn1cc7n(C)c1=O.c18cncc(F)c1.C47=O.C58=O.C69.N56
|
O=C(c1csc(CO)n1)N1CCC([C@@H]2CCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1
|
O=CccscCO))n5)))))NCCC[C@@H]CCCN5C=O)[C@H]CCCS5=O)=O))))))))))))CC6
|
[O][=C][Branch1][N][C][=C][S][C][Branch1][Ring1][C][O][=N][Ring1][#Branch1][N][C][C][C][Branch2][Ring1][#Branch1][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O][C][C][Ring2][Ring1][Ring2]
|
N13CCC8CC1.[C@H]15CCCS1(=O)=O.c16csc7n1.[C@@H]18CCCN14.O=C36.C45=O.C7O
|
C[C@H](CF)C(=O)NC[C@H](O)CNC(=O)c1cccc2c1CCCC2
|
C[C@H]CF))C=O)NC[C@H]O)CNC=O)cccccc6CCCC6
|
[C][C@H1][Branch1][Ring1][C][F][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][=Branch1]
|
c17cccc2c1CCCC2.C[C@H](CF)C3=O.C5[C@H](O)C6.C47=O.N35.N46
|
COn1cnc(C)c1C(=O)N1C[C@H](C(=O)Nc2cccc(C)c2)C(C)(C)C1
|
COncncC)c5C=O)NC[C@H]C=O)NcccccC)c6))))))))CC)C)C5
|
[C][O][N][C][=N][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Branch1][C][C][Branch1][C][C][C][Ring1][P]
|
COn1cnc(C)c16.N13C[C@H]7C(C)(C)C1.c15cccc(C)c1.C36=O.C47=O.N45
|
O=C(C[C@H]1CNC(=O)O1)N[C@@H]1C[C@@H](C(=O)O)c2ccccc21
|
O=CC[C@H]CNC=O)O5))))))N[C@@H]C[C@@H]C=O)O))cccccc69
|
[O][=C][Branch1][N][C][C@H1][C][N][C][=Branch1][C][=O][O][Ring1][=Branch1][N][C@@H1][C][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N]
|
N3[C@@H]1C[C@@H](C(=O)O)c2ccccc21.[C@H]14CNC(=O)O1.O=C3C4
|
C[C@@H](NC(=O)COc1cccc(F)c1)[C@@H](CO)NC(=O)[C@@](O)(C1CC1)C(F)(F)F
|
C[C@@H]NC=O)COcccccF)c6))))))))))[C@@H]CO))NC=O)[C@@]O)CCC3)))CF)F)F
|
[C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@][Branch1][C][O][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Branch1][C][F][Branch1][C][F][F]
|
C3(=O)[C@]8(O)C(F)(F)F.c15cccc(F)c1.C[C@@H]6[C@H]7CO.C2(=O)C4.C18CC1.N26.O45.N37
|
CCO[C@@H]1C[C@H]1C(=O)N1CC2(CC(CNC(=O)C(=O)C(C)(C)C)C2)C1
|
CCO[C@@H]C[C@H]3C=O)NCCCCCNC=O)C=O)CC)C)C))))))C4)))C4
|
[C][C][O][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][O][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=C][C][Ring1][P]
|
N13CC2(CC9C2)C1.C4(=O)C(=O)C(C)(C)C.[C@@H]16C[C@H]18.C38=O.CC5.O56.C79.N47
|
Cc1cc(NC(=O)N2CCCCC[C@H]2CC(C)C)c2ncccc2c1
|
CcccNC=O)NCCCCC[C@H]7CCC)C))))))))))))cncccc6c%10
|
[C][C][=C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][C][C@H1][Ring1][#Branch1][C][C][Branch1][C][C][C][=C][N][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring1][Branch2]
|
Cc1cc5c2ncccc2c1.N14CCCCC[C@H]16.C6C(C)C.C34=O.N35
|
CC(C)CCC=CC(=O)N[C@H]1CCC[C@H]1C(=O)NCC1CCC=CCC1
|
CCC)CCC=CC=O)N[C@H]CCC[C@H]5C=O)NCCCCC=CCC7
|
[C][C][Branch1][C][C][C][C][C][=C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][=C][C][C][Ring1][#Branch1]
|
C18CCC=CCC1.CC(C)CCC=7.[C@H]15CCC[C@H]16.C=7C2=O.C36=O.N25.N34.C48
|
COc1nc(Cl)nc2c1CN([C@H](C#N)C1CCCC1)CC2
|
COcncCl)ncc6CN[C@H]C#N))CCCCC5))))))CC6
|
[C][O][C][=N][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][C][N][Branch1][=N][C@H1][Branch1][Ring1][C][#N][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][=C]
|
c13nc(Cl)nc2c1CN4CC2.C15CCCC1.[C@H]45C#N.CO3
|
Cn1[nH]c(C(=O)N2CCN(C(=O)Cc3cnns3)[C@@H](c3cccnc3)C2)nc1=O
|
Cn[nH]cC=O)NCCNC=O)Cccnns5)))))))[C@@H]ccccnc6))))))C6)))))))nc5=O
|
[C][N][NH1][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][N][=N][S][Ring1][Branch1][C@@H1][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][=N][C][Ring2][Ring1][O][=O]
|
N14CCN5[C@@H]8C1.Cn1[nH]c6nc1=O.c18cccnc1.c17cnns1.C5(=O)C7.C46=O
|
Cc1ocnc1CC(=O)N1CCC(C)(C)[C@H](NC(=O)c2ccoc2C2CC2)C1
|
Ccocnc5CC=O)NCCCC)C)[C@H]NC=O)cccoc5CCC3))))))))))C6
|
[C][C][O][C][=N][C][=Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][O][C][=Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][Ring1]
|
N13CCC(C)(C)[C@H]5C1.Cc1ocnc17.c16ccoc18.C7C3=O.C46=O.C18CC1.N45
|
CC(C)CCC(=O)N1CC(CNC(=O)c2c[nH]c(=O)c3ccnn23)(C(C)(C)O)C1
|
CCC)CCC=O)NCCCNC=O)cc[nH]c=O)cccnn95))))))))))))CC)C)O))C4
|
[C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][NH1][C][=Branch1][C][=O][C][=C][C][=N][N][Ring1][#Branch2][Ring1][Branch1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][O][C][Ring2][Ring1][=Branch1]
|
c17c[nH]c(=O)c2ccnn12.CC(C)CCC4=O.N14CC89C1.C9(C)(C)O.C57=O.C68.N56
|
Cc1cc(C)nc(SCC(=O)N2CCO[C@H](CNC(=O)[C@@H]3CC(=O)N(C)C3)C2)n1
|
CcccC)ncSCC=O)NCCO[C@H]CNC=O)[C@@H]CC=O)NC)C5))))))))C6)))))))))n6
|
[C][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring2][Branch1][S][C][C][=Branch1][C][=O][N][C][C][O][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Ring1][#Branch1][C][Ring1][P][=N][Ring2][Ring1][N]
|
Cc1cc(C)nc%10n1.N14CCO[C@H]9C1.[C@@H]18CC(=O)N(C)C1.C7C4=O.C58=O.S7%10.C69.N56
|
Cc1c(CNC(=O)Nc2cccn(CC(=O)N(C)C)c2=O)ccc(Cl)c1Cl
|
CccCNC=O)NccccnCC=O)NC)C))))c6=O)))))))))))cccCl)c6Cl
|
[C][C][=C][Branch2][Ring1][=N][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][N][Branch1][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Ring1][N][=O][C][=C][C][Branch1][C][Cl][=C][Ring2][Ring1][=Branch2][Cl]
|
Cc1c9ccc(Cl)c1Cl.c17cccn8c1=O.C8C5=O.C34=O.N5(C)C.C69.N36.N47
|
O=C(N[C@H](CO)C1(O)CC1)c1ccc(CNC(=O)c2csc(Cl)n2)cc1
|
O=CN[C@H]CO))CO)CC3)))))ccccCNC=O)ccscCl)n5))))))))cc6
|
[O][=C][Branch1][#C][N][C@H1][Branch1][Ring1][C][O][C][Branch1][C][O][C][C][Ring1][Ring2][C][=C][C][=C][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Cl][=N][Ring1][=Branch1][C][=C][Ring1][S]
|
c18ccc%10cc1.c17csc(Cl)n1.[C@H]59CO.C19(O)CC1.O=C38.C47=O.N35.C6%10.N46
|
Cc1nn(C)c(F)c1C(=O)N[C@@H]1CN(C(=O)C2CC3(CCC3)C2)CC[C@H]1C
|
CcnnC)cF)c5C=O)N[C@@H]CNC=O)CCCCCC4)))C4)))))CC[C@H]6C
|
[C][C][=N][N][Branch1][C][C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][#Branch1][C][C][C@H1][Ring1][#C][C]
|
Cc1nn(C)c(F)c18.[C@@H]16CN5CC[C@H]1C.C17CC2(CCC2)C1.C48=O.C57=O.N46
|
O=C(N1CCC[C@H](NC(=O)[C@]23CC=CCN2CCC3)C1)C12[C@@H]3CC(C[C@@H]31)C2(F)F
|
O=CNCCC[C@H]NC=O)[C@]CC=CCN6CCC9)))))))))))C6))))))C[C@@H]CCC[C@@H]56))C5F)F
|
[O][=C][Branch2][Ring1][#C][N][C][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@][C][C][=C][C][N][Ring1][=Branch1][C][C][C][Ring1][=Branch2][C][Ring2][Ring1][C][C][C@@H1][C][C][Branch1][#Branch1][C][C@@H1][Ring1][Branch1][Ring1][=Branch1][C][Ring1][#Branch1][Branch1][C][F][F]
|
[C@]127CC=CCN1CCC2.C128[C@@H]3CC(C[C@@H]31)C2(F)F.N14CCC[C@H]6C1.O=C48.C57=O.N56
|
COc1cc(CCNC(=O)C(=O)N=c2cc(C)n(C3CC3)[nH]2)ccn1
|
COcccCCNC=O)C=O)N=cccC)nCCC3)))[nH]5)))))))))))ccn6
|
[C][O][C][=C][C][Branch2][Ring1][=C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][=C][C][=C][Branch1][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][NH1][Ring1][=Branch2][=C][C][=N][Ring2][Ring1][#Branch1]
|
C4(=O)C(=O)N=c1cc(C)n8[nH]1.c15cc7ccn1.C7C6.C18CC1.CO5.N46
|
C[C@H](CNC(=O)c1cc(NC2CC2)ncc1Cl)NC(=O)[C@@H]1C[C@@H]2CCC[C@@H](C2)C1
|
C[C@H]CNC=O)cccNCCC3))))ncc6Cl))))))))))NC=O)[C@@H]C[C@@H]CCC[C@@H]C6)C8
|
[C][C@H1][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch1][N][C][C][C][Ring1][Ring1][=N][C][=C][Ring1][#Branch2][Cl][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][C][C][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2]
|
[C@H]19C[C@H]2CCC[C@@H](C1)C2.c1%10cc7ncc1Cl.C[C@@H]5C6.C3%10=O.C18CC1.C49=O.N36.N78.N45
|
O=C(NCC1(C(=O)N[C@H]2CCCNC2=O)CC1)C(Cl)Cl
|
O=CNCCC=O)N[C@H]CCCNC6=O)))))))))CC3)))))CCl)Cl
|
[O][=C][Branch2][Ring1][Branch2][N][C][C][Branch1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C][N][C][Ring1][=Branch1][=O][C][C][Ring1][=N][C][Branch1][C][Cl][Cl]
|
[C@H]16CCCNC1=O.O=C3C(Cl)Cl.C178CC1.C47=O.N35.C58.N46
|
CCc1cc(CNC(=O)[C@@](C)(NC(=O)c2nc(C)c(C)s2)C2CCC2)on1
|
CCcccCNC=O)[C@@]C)NC=O)cncC)cC)s5)))))))CCCC4))))))))on5
|
[C][C][C][C][=C][Branch2][Ring2][=Branch1][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][C][Branch1][C][C][=C][Branch1][C][C][S][Ring1][#Branch1][C][C][C][C][Ring1][Ring2][O][N][=Ring2][Ring1][=Branch2]
|
c17nc(C)c(C)s1.c18cc9on1.C3(=O)[C@@]6%10C.C1%10CCC1.C47=O.CC8.C59.N35.N46
|
O=C(NC/C=C/CNC(=O)[C@@H](O)c1cnc[nH]1)c1cc2c(nn1)CCC2
|
O=CNC/C=C/CNC=O)[C@@H]O)ccnc[nH]5)))))))))))))ccccnn6))CCC5
|
[O][=C][Branch2][Ring1][=Branch1][N][C][/C][=C][/C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][N][=C][NH1][Ring1][Branch1][C][=C][C][=C][Branch1][Branch1][N][=N][Ring1][=Branch1][C][C][C][Ring1][#Branch1]
|
c17cc2c(nn1)CCC2.C4(=O)[C@H]9O.c19cnc[nH]1.O=C37.C5C=8.C=8C6.N35.N46
|
CC[C@H](CC(=O)N1CC[C@H](C(=O)N2CC(NC(=O)OC)C2)O1)C(F)F
|
CC[C@H]CC=O)NCC[C@H]C=O)NCCNC=O)OC))))C4)))))O5)))))))CF)F
|
[C][C][C@H1][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][N][C][=Branch1][C][=O][O][C][C][Ring1][=Branch2][O][Ring1][S][C][Branch1][C][F][F]
|
CC[C@H](CC(=O)N1CC[C@H]7O1)C(F)F.N14CC6C1.C47=O.C35=O.N56.O3C
|
C[C@@H]1[C@H](C)[C@@H]1C(=O)NCC=C1CCN(C(=O)c2ccc(N(C)C)cc2F)CC1
|
C[C@@H][C@H]C)[C@@H]3C=O)NCC=CCCNC=O)ccccNC)C))cc6F))))))))CC6
|
[C][C@@H1][C@H1][Branch1][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][=C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][=Branch2][F][C][C][Ring2][Ring1][C]
|
c18ccc6cc1F.C1=9CCN4CC1.C[C@H]1[C@@H]7[C@H]1C.C37=O.C5C=9.C48=O.N6(C)C.N35
|
CSC(C)(C)/C=C/C(=O)N[C@@H](CCNC(=O)C[C@@H]1CCCO1)Cc1ccccc1
|
CSCC)C)/C=C/C=O)N[C@@H]CCNC=O)C[C@@H]CCCO5))))))))))Ccccccc6
|
[C][S][C][Branch1][C][C][Branch1][C][C][/C][=C][/C][=Branch1][C][=O][N][C@@H1][Branch1][S][C][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][O][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
[C@@H]4(C9)CC5.c19ccccc1.C6(C)(C)C=7.[C@@H]18CCCO1.C=7C2=O.C3(=O)C8.CS6.N24.N35
|
COC(=O)C[C@H](C)CCC(=O)N[C@H](CNC(=O)C(F)(F)[C@@H](O)C(C)C)CC(C)C
|
COC=O)C[C@H]C)CCC=O)N[C@H]CNC=O)CF)F)[C@@H]O)CC)C)))))))CCC)C
|
[C][O][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C@@H1][Branch1][C][O][C][Branch1][C][C][C][C][C][Branch1][C][C][C]
|
C1(=O)C[C@H](C)CCC2=O.C3(=O)C(F)(F)[C@@H](O)C(C)C.[C@@H]4(C5)CC(C)C.CO1.N24.N35
|
CC[C@H](C(=O)N[C@@H](Cc1cc[nH]n1)C(=O)NCCCCSC)C(=O)OC
|
CC[C@H]C=O)N[C@@H]Cccc[nH]n5))))))C=O)NCCCCSC)))))))))))C=O)OC
|
[C][C][C@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][C][=C][NH1][N][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][S][C][C][=Branch1][C][=O][O][C]
|
CC[C@@H](C2=O)C3=O.[C@H]5(C8)C4=O.c18cc[nH]n1.C6CCC7.N35.N46.S7C.O2C
|
C#CC[C@@H](O)C(=O)N1CCC2(CC1)CC(NC(=O)[C@H](C)Cc1ccc(F)cc1)C2
|
C#CC[C@@H]O)C=O)NCCCCC6))CCNC=O)[C@H]C)CccccF)cc6))))))))))C4
|
[C][#C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring1][Ring1]
|
N13CCC2(CC1)CC5C2.C#CC[C@@H](O)C3=O.c16ccc(F)cc1.C4(=O)[C@H](C)C6.N45
|
C#CCOCC(=O)N1CCC2(CC1)C[C@@H]2CNC(=O)CS[C@@H]1CCS(=O)(=O)C1
|
C#CCOCC=O)NCCCCC6))C[C@@H]3CNC=O)CS[C@@H]CCS=O)=O)C5
|
[C][#C][C][O][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][S][C@@H1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][#Branch1]
|
N13CCC2(CC1)C[C@@H]29.[C@@H]1%10CCS(=O)(=O)C1.C6C3=O.C4(=O)C8.C#CC5.O56.C79.N47.S8%10
|
COc1cccnc1C(=O)NC[C@@]1(C)CCCN1C(=O)Cc1scnc1C
|
COccccnc6C=O)NC[C@@]C)CCCN5C=O)Ccscnc5C
|
[C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][S][C][=N][C][=Ring1][Branch1][C]
|
c14cccnc16.[C@]17(C)CCCN13.c18scnc1C.C3(=O)C8.C26=O.CO4.N25.C57
|
COc1ncccc1C(=O)N[C@@H](C)[C@H]1CCCN(C(=O)C(C)=Cc2cn[nH]c2)C1
|
COcncccc6C=O)N[C@@H]C)[C@H]CCCNC=O)CC)=Cccn[nH]c5))))))))C6
|
[C][O][C][=N][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@H1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][Branch1][C][C][=C][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring1][S]
|
c15ncccc17.[C@H]19CCCN4C1.C=8c1cn[nH]c1.C4(=O)C=8C.C37=O.[C@@H]69C.CO5.N36
|
C=CCOCCCC(=O)N1CC[C@@H](NC(=O)CC2(O)CCOCC2)C12CC2
|
C=CCOCCCC=O)NCC[C@@H]NC=O)CCO)CCOCC6)))))))))C5CC3
|
[C][=C][C][O][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][Branch1][C][O][C][C][O][C][C][Ring1][#Branch1][C][Ring1][S][C][C][Ring1][Ring1]
|
N13CC[C@@H]7C12CC2.C18(O)CCOCC1.C6CCC3=O.C4(=O)C8.C=CC5.O56.N47
|
CN(C)C(=O)C#CC(=O)NC(C)(C)CCCNC(=O)[C@@H](O)C1CC1
|
CNC)C=O)C#CC=O)NCC)C)CCCNC=O)[C@@H]O)CCC3
|
[C][N][Branch1][C][C][C][=Branch1][C][=O][C][#C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][Ring1][Ring1]
|
C2(=O)C#CC3=O.C5(C)(C)CCC6.C4(=O)[C@H]7O.CN2C.C17CC1.N35.N46
|
Cc1ccnn1CC(=O)NC[C@H](C)CC(=O)NCC1[C@H]2CCC[C@H]12
|
Ccccnn5CC=O)NC[C@H]C)CC=O)NCC[C@H]CCC[C@H]65
|
[C][C][=C][C][=N][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C][C@H1][Ring1][=Branch1][Ring1][Branch1]
|
C5[C@H](C)CC4=O.Cc1ccnn17.C18[C@H]2CCC[C@H]12.C7C3=O.N35.N46.C68
|
CCc1ncc(C(=O)N2CCC(O)(CNC(=O)C(C)(C)CCCO)CC2)c(O)n1
|
CCcnccC=O)NCCCO)CNC=O)CC)C)CCCO))))))))CC6)))))))cO)n6
|
[C][C][C][=N][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][C][Ring2][Ring1][C][C][Branch1][C][O][=N][Ring2][Ring1][O]
|
C4(=O)C(C)(C)CCCO.c17ncc6c(O)n1.N13CCC8(O)CC1.C36=O.CC7.C58.N45
|
CCN1C[C@H](C(=O)N2CC3(CCN(C(=O)COCCCC(C)C)CC3)C2)CC1=O
|
CCNC[C@H]C=O)NCCCCNC=O)COCCCCC)C))))))))CC6)))))C4)))))CC5=O
|
[C][C][N][C][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][O][C][C][C][C][Branch1][C][C][C][C][C][Ring1][S][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][#Branch2][=O]
|
N14CC2(CCN5CC2)C1.N19C[C@H]8CC1=O.C7CCC(C)C.C5(=O)C6.C48=O.CC9.O67
|
CCO[C@H](C(=O)NCCCCNC(=O)c1cccc(C2CC2)n1)[C@H]1CCOC1
|
CCO[C@H]C=O)NCCCCNC=O)cccccCCC3)))n6))))))))))))))[C@H]CCOC5
|
[C][C][O][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][=Branch2][C@H1][C][C][O][C][Ring1][Branch1]
|
c19cccc%11n1.[C@H]6%10C3=O.C7CCC8.[C@H]1%10CCOC1.C49=O.C1%11CC1.CC5.O56.N37.N48
|
CC1=NO[C@H](C(=O)N[C@H]2[C@@H](C(=O)NCCNC(=O)C3CCC3)C2(C)C)C1
|
CC=NO[C@H]C=O)N[C@H][C@@H]C=O)NCCNC=O)CCCC4))))))))))C3C)C))))))C5
|
[C][C][=N][O][C@H1][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@H1][C@@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][Ring1][#C][Branch1][C][C][C][C][Ring2][Ring1][=Branch2]
|
CC1=NO[C@H]%10C1.[C@H]19[C@@H]%11C1(C)C.C1%12CCC1.C4%10=O.C5%11=O.C7C8.C6%12=O.N49.N57.N68
|
CCOC(=O)C=CC(=O)N(C)CCCCN(C)C(=O)c1c(C)nn(C)c1C
|
CCOC=O)C=CC=O)NC)CCCCNC)C=O)ccC)nnC)c5C
|
[C][C][O][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][#Branch1][C]
|
c18c(C)nn(C)c1C.C6CCC7.C2(=O)C=9.C=9C3=O.N36C.N47C.C48=O.CC5.O25
|
O=C(NC[C@H]1CCN(C(=O)[C@]2(C3CCC3)CC2(F)F)C1)[C@@]1(F)CCS(=O)(=O)C1
|
O=CNC[C@H]CCNC=O)[C@]CCCC4))))CC3F)F)))))C5)))))))[C@@]F)CCS=O)=O)C5
|
[O][=C][Branch2][Ring2][C][N][C][C@H1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C@][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][C][Ring1][#Branch1][Branch1][C][F][F][C][Ring1][S][C@@][Branch1][C][F][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][Branch2]
|
[C@@]18(C2CCC2)CC1(F)F.[C@]17(F)CCS(=O)(=O)C1.[C@H]19CCN5C1.O=C47.C58=O.N46.C69
|
COCC12CC(NC(=O)[C@@H](C)SC(C)C)(CN1C(=O)C1CCCC1)C2
|
COCCCCNC=O)[C@@H]C)SCC)C))))))CN5C=O)CCCCC5))))))))C4
|
[C][O][C][C][C][C][Branch1][S][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][S][C][Branch1][C][C][C][Branch1][S][C][N][Ring1][=C][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][=Branch1]
|
C12%10CC8(CN14)C2.C3(=O)[C@H]6C.C19CCCC1.C7(C)C.C49=O.CO5.C5%10.N38.S67
|
CC[C@H](O)c1cn(C2(C(=O)N(C)CCNC(=O)OC(C)(C)C)CC2)nn1
|
CC[C@H]O)ccnCC=O)NC)CCNC=O)OCC)C)C)))))))))CC3)))nn5
|
[C][C][C@H1][Branch1][C][O][C][=C][N][Branch2][Ring1][P][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][P][N][=N][Ring2][Ring1][=Branch1]
|
c1%10cn%11nn1.CC[C@@H]%10O.C19%11CC1.C6(C)(C)C.C49=O.N47C.C7C8.C35=O.N58.O36
|
Cc1ccc(C(=O)N2CC3(CCN(C(=O)c4c[nH]nc4C)C3)C2)nc1O
|
CccccC=O)NCCCCNC=O)cc[nH]nc5C)))))))C5))))C4)))))nc6O
|
[C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][C][C][Ring1][=N][C][Ring1][S][N][=C][Ring2][Ring1][Branch2][O]
|
N15CC2(CCN6C2)C1.Cc1ccc7nc1O.c18c[nH]nc1C.C57=O.C68=O
|
Cc1cc(C#N)c(F)cc1NC(=O)CCc1ccc(C(=O)Nc2ccno2)[nH]1
|
CcccC#N))cF)cc6NC=O)CCccccC=O)Ncccno5)))))))[nH]5
|
[C][C][=C][C][Branch1][Ring1][C][#N][=C][Branch1][C][F][C][=C][Ring1][=Branch2][N][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][N][C][=C][C][=N][O][Ring1][Branch1][NH1][Ring1][=N]
|
Cc1cc(C#N)c(F)cc16.c18ccc7[nH]1.C3(=O)CC8.c15ccno1.C47=O.N36.N45
|
CC[C@@H](CNC(=O)C=Cc1nccs1)NC(=O)Cc1c(C)noc1Cl
|
CC[C@@H]CNC=O)C=Ccnccs5))))))))))NC=O)CccC)noc5Cl
|
[C][C][C@@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][S][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][=N][O][C][=Ring1][=Branch1][Cl]
|
c17c(C)noc1Cl.C=6c1nccs1.CC[C@H]4C5.C2(=O)C=6.C3(=O)C7.N25.N34
|
CCN1CCN(C(=O)C[C@@H]2CCN(C(=O)C[C@@H]3CCCC(=O)C3)C2)C[C@H]1C
|
CCNCCNC=O)C[C@@H]CCNC=O)C[C@@H]CCCC=O)C6))))))))C5)))))))C[C@H]6C
|
[C][C][N][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C@@H1][C][C][C][C][=Branch1][C][=O][C][Ring1][#Branch1][C][Ring1][#C][C][C@H1][Ring2][Ring1][Branch2][C]
|
N16CCN4C[C@H]1C.[C@@H]18CCCC(=O)C1.[C@@H]17CCN5C1.C4(=O)C7.C5(=O)C8.CC6
|
CN1CCN(C)[C@@H](C(=O)N[C@H]2CCC[C@H]2CN(C)C(=O)c2sccc2Cl)C1
|
CNCCNC)[C@@H]C=O)N[C@H]CCC[C@H]5CNC)C=O)csccc5Cl))))))))))))))))C6
|
[C][N][C][C][N][Branch1][C][C][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@H1][C][C][C][C@H1][Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][Cl][C][Ring2][Ring1][#Branch2]
|
CN1CCN(C)[C@@H]7C1.[C@H]16CCC[C@H]19.c18sccc1Cl.C37=O.N45C.C48=O.N36.C59
|
C[C@H](NC(=O)[C@@H](F)[C@H]1CCN(C(=O)C=Cc2cncn2C)C1)c1cn[nH]c1
|
C[C@H]NC=O)[C@@H]F)[C@H]CCNC=O)C=Cccncn5C)))))))))C5))))))))ccn[nH]c5
|
[C][C@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][C][=C][N][=C][N][Ring1][Branch1][C][C][Ring1][#C][C][C][=N][NH1][C][=Ring1][Branch1]
|
C=6c1cncn1C.[C@H]17CCN4C1.C3(=O)[C@H]7F.c18cn[nH]c1.C4(=O)C=6.C[C@H]58.N35
|
C[C@@H](CC(N)=O)c1ccc(NC(=O)C2CCN(C3CCNCC3)CC2)cc1
|
C[C@@H]CCN)=O)))ccccNC=O)CCCNCCCNCC6))))))CC6))))))))cc6
|
[C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][C][N][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][C][C][Ring1][N][C][=C][Ring2][Ring1][Branch1]
|
c18ccc5cc1.C17CCN6CC1.C[C@H]8CC(N)=O.C16CCNCC1.C47=O.N45
|
O=C(CC1CCN(C(=O)Cc2cc[nH]c2)CC1)NC[C@H](O)C1CC1
|
O=CCCCCNC=O)Cccc[nH]c5)))))))CC6)))))))NC[C@H]O)CCC3
|
[O][=C][Branch2][Ring1][Branch2][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][NH1][C][=Ring1][Branch1][C][C][Ring1][=C][N][C][C@H1][Branch1][C][O][C][C][C][Ring1][Ring1]
|
C16CCN4CC1.c18cc[nH]c1.O=C3C6.C4(=O)C8.C5[C@@H]7O.C17CC1.N35
|
CC1(C)CC(C(=O)N[C@@H]2CC23CC(NC(=O)[C@@H]2CC=C[C@H](O)C2)C3)=NO1
|
CCC)CCC=O)N[C@@H]CC3CCNC=O)[C@@H]CC=C[C@H]O)C6))))))))C4))))))))=NO5
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@@H1][C][C][Ring1][Ring1][C][C][Branch1][P][N][C][=Branch1][C][=O][C@@H1][C][C][=C][C@H1][Branch1][C][O][C][Ring1][#Branch1][C][Ring1][=C][=N][O][Ring2][Ring1][=Branch2]
|
CC1(C)CC(C4=O)=NO1.[C@@H]16CC12CC7C2.[C@@H]18CC=C[C@H](O)C1.C58=O.N46.N57
|
CCCCCc1nc(C(=O)N(CC)CCNC(=O)Cc2ccn(C(F)F)n2)cs1
|
CCCCCcncC=O)NCC))CCNC=O)CcccnCF)F))n5))))))))))))cs5
|
[C][C][C][C][C][C][=N][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][C][C][=C][N][Branch1][=Branch1][C][Branch1][C][F][F][N][=Ring1][Branch2][=C][S][Ring2][Ring1][Branch2]
|
c1%10nc8cs1.c1%11ccn9n1.CCCCC%10.C4(=O)C%11.C38=O.N356.C6C7.C9(F)F.C5C.N47
|
CC[C@H](NC(C)=O)C(=O)N1CC[C@H](NC(=O)c2cnc3ncccn23)[C@H]1C(C)C
|
CC[C@H]NCC)=O)))C=O)NCC[C@H]NC=O)ccncncccn96)))))))))))[C@H]5CC)C
|
[C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][C@H1][Ring1][P][C][Branch1][C][C][C]
|
c19cnc2ncccn12.N15CC[C@H]8[C@H]1%10.CC[C@H]7C5=O.C4(C)=O.C69=O.C%10(C)C.N47.N68
|
CC1=C[C@@H]1C(=O)NCC1[C@@H]2CN(C(=O)C3(F)CCCCC3)C[C@@H]12
|
CC=C[C@@H]3C=O)NCC[C@@H]CNC=O)CF)CCCCC6)))))))C[C@@H]65
|
[C][C][=C][C@@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][F][C][C][C][C][C][Ring1][#Branch1][C][C@@H1][Ring1][#C][Ring1][=C]
|
C19[C@@H]2CN5C[C@@H]12.C18(F)CCCCC1.CC1=C[C@@H]17.C47=O.C58=O.N46.C69
|
O=C(Cc1ccns1)N[C@@H](C(=O)NCCn1ncnn1)C1CCC1
|
O=CCcccns5))))))N[C@@H]C=O)NCCnncnn5)))))))))CCCC4
|
[O][=C][Branch1][=Branch2][C][C][=C][C][=N][S][Ring1][Branch1][N][C@@H1][Branch1][#C][C][=Branch1][C][=O][N][C][C][N][N][=C][N][=N][Ring1][Branch1][C][C][C][C][Ring1][Ring2]
|
c17ccns1.[C@@H]48C3=O.n16ncnn1.O=C2C7.C18CCC1.C5C6.N24.N35
|
CC1(C)COC[C@H]1CNC(=O)C(C)(C)[C@H]1CCCN(C(=O)CCn2ccnn2)C1
|
CCC)COC[C@H]5CNC=O)CC)C)[C@H]CCCNC=O)CCnccnn5))))))))C6
|
[C][C][Branch1][C][C][C][O][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@H1][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][#C]
|
CC1(C)COC[C@H]17.[C@H]18CCCN4C1.C3(=O)C8(C)C.C4(=O)CC6.n16ccnn1.C57.N35
|
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