SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
COc1ccsc1C(=O)N[C@H]1CN(C(=O)c2c(F)cc(C)cc2F)CC12CC2
|
COcccsc5C=O)N[C@H]CNC=O)ccF)ccC)cc6F))))))))CC5CC3
|
[C][O][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][Branch1][C][C][C][=C][Ring1][Branch2][F][C][C][Ring1][S][C][C][Ring1][Ring1]
|
c18c(F)cc(C)cc1F.[C@H]16CN4CC12CC2.c15ccsc17.C37=O.C48=O.CO5.N36
|
Cc1ncsc1CCC(=O)N(CCNC(=O)c1cnc2occc2c1)C[C@H](C)O
|
Ccncsc5CCC=O)NCCNC=O)ccncoccc5c9)))))))))))))C[C@H]C)O
|
[C][C][N][=C][S][C][=Ring1][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][O][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C@H1][Branch1][C][C][O]
|
c18cnc2occc2c1.Cc1ncsc19.C9CC3=O.C7[C@H](C)O.N357.C5C6.C48=O.N46
|
CCc1ncc(C(=O)NC[C@@H]2CN(C(=O)CCC(C)C)[C@H]3C[C@@H]23)c(O)n1
|
CCcnccC=O)NC[C@@H]CNC=O)CCCC)C)))))[C@H]C[C@@H]63)))))))))cO)n6
|
[C][C][C][=N][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][C@H1][C][C@@H1][Ring1][=N][Ring1][Ring1][C][Branch1][C][O][=N][Ring2][Ring1][Branch2]
|
c18ncc7c(O)n1.[C@@H]19CN5[C@H]2C[C@@H]12.C5(=O)CCC(C)C.C47=O.CC8.N46.C69
|
C[C@@H](C(=O)N1CC[C@]2(CCCC[C@@H]2NC(=O)COC2CCOCC2)C1)N(C)C
|
C[C@@H]C=O)NCC[C@]CCCC[C@@H]6NC=O)COCCCOCC6)))))))))))))))C5))))))NC)C
|
[C][C@@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C@][Branch2][Ring1][#Branch1][C][C][C][C][C@@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][O][C][C][C][O][C][C][Ring1][=Branch1][C][Ring2][Ring1][Branch1][N][Branch1][C][C][C]
|
N13CC[C@]2(CCCC[C@@H]28)C1.C16CCOCC1.C[C@H]7C3=O.C4(=O)C5.N7(C)C.N48.O56
|
C[C@@H](CC1CN(C(=O)CC(F)(F)C(F)F)C1)NC(=O)C#CC(C)(C)C
|
C[C@@H]CCCNC=O)CCF)F)CF)F)))))C4)))))NC=O)C#CCC)C)C
|
[C][C@@H1][Branch2][Ring1][N][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F][C][Ring1][=N][N][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][Branch1][C][C][C]
|
C2(=O)CC(F)(F)C(F)F.C3(=O)C#CC(C)(C)C.C15CN2C1.C[C@H]4C5.N34
|
CCC=CC(=O)NC[C@@H]1C[C@H](F)CN1C(=O)c1ccc(C(C)(C)C)cc1C
|
CCC=CC=O)NC[C@@H]C[C@H]F)CN5C=O)ccccCC)C)C))cc6C
|
[C][C][C][=C][C][=Branch1][C][=O][N][C][C@@H1][C][C@H1][Branch1][C][F][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C]
|
c15ccc8cc1C.[C@@H]17C[C@H](F)CN13.C=6C2=O.C8(C)(C)C.CCC=6.C35=O.N24.C47
|
Cc1ccc(C(=O)N[C@]2(C)CCN(c3ncnc4c3CCCC4)C2)c(C)c1
|
CccccC=O)N[C@]C)CCNcncncc6CCCC6))))))))))C5)))))))cC)c6
|
[C][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C][N][Branch1][#C][C][=N][C][=N][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][=Branch1][C][Ring1][S][C][Branch1][C][C][=C][Ring2][Ring1][#Branch2]
|
c17ncnc2c1CCCC2.Cc1ccc8c(C)c1.[C@@]16(C)CCN7C1.C58=O.N56
|
CC(=CC(=O)N[C@H](C)CCNC(=O)c1ccnc2[nH]ncc12)c1cccnc1
|
CC=CC=O)N[C@H]C)CCNC=O)cccnc[nH]ncc95)))))))))))))))))ccccnc6
|
[C][C][=Branch2][Ring1][#C][=C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][NH1][N][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
c17ccnc2[nH]ncc12.CC=8c1cccnc1.[C@@H]5(C)CC6.C=8C3=O.C47=O.N35.N46
|
CCC[C@H](C(=O)N[C@@H](CO)C1CCN(C(=O)c2cnc(COC)s2)CC1)C(C)C
|
CCC[C@H]C=O)N[C@@H]CO))CCCNC=O)ccncCOC)))s5))))))CC6)))))))))CC)C
|
[C][C][C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][N][=C][Branch1][Ring2][C][O][C][S][Ring1][Branch2][C][C][Ring1][S][C][Branch1][C][C][C]
|
CCC[C@H](C3=O)C(C)C.C19CCN4CC1.c17cnc8s1.[C@@H]69CO.C47=O.N36.C58.O5C
|
CC(C)[C@]1(C(=O)N2CCOC[C@H](CO)C2)CCN(C(=O)[C@H]2CCC(=O)O2)C1
|
CCC)[C@]C=O)NCCOC[C@H]CO))C7))))))))CCNC=O)[C@H]CCC=O)O5))))))C5
|
[C][C][Branch1][C][C][C@][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][O][C][C@H1][Branch1][Ring1][C][O][C][Ring1][=Branch2][C][C][N][Branch1][#C][C][=Branch1][C][=O][C@H1][C][C][C][=Branch1][C][=O][O][Ring1][=Branch1][C][Ring2][Ring1][Branch2]
|
N13CCOC[C@H]8C1.[C@]167CCN4C1.[C@H]15CCC(=O)O1.CC7C.C36=O.C45=O.C8O
|
CN1C[C@@H]2CCN(C(=O)C3(F)CN(C(=O)c4cnccc4C#N)C3)[C@H]2C1
|
CNC[C@@H]CCNC=O)CF)CNC=O)ccnccc6C#N)))))))))C4)))))[C@H]5C8
|
[C][N][C][C@@H1][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C][Branch1][C][F][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][#N][C][Ring1][#C][C@H1][Ring2][Ring1][=Branch1][C][Ring2][Ring1][=Branch2]
|
CN1C[C@@H]2CCN5[C@H]2C1.c18cnccc1C#N.C17(F)CN6C1.C57=O.C68=O
|
COCCc1nnc(N2CCN(C)[C@@H](CNC(=O)CNC(=O)CC(F)(F)F)C2)s1
|
COCCcnncNCCNC)[C@@H]CNC=O)CNC=O)CCF)F)F)))))))))C6))))))s5
|
[C][O][C][C][C][=N][N][=C][Branch2][Ring2][Branch1][N][C][C][N][Branch1][C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][Ring2][S][Ring2][Ring1][=Branch2]
|
N18CCN(C)[C@@H]9C1.C4(=O)CC(F)(F)F.c1%10nnc8s1.C3(=O)C7.C5C%10.CO5.C69.N36.N47
|
CCC(C)(CC)C(=O)NCCOCCN(C)C(=O)/C=C/C(=O)c1ccc(F)cc1
|
CCCC)CC))C=O)NCCOCCNC)C=O)/C=C/C=O)ccccF)cc6
|
[C][C][C][Branch1][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C][N][Branch1][C][C][C][=Branch1][C][=O][/C][=C][/C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
|
CCC(C)(CC)C2=O.c18ccc(F)cc1.C3(=O)C=9.C=9C8=O.C6C4.C5C7.N37C.N26.O45
|
O=C(N[C@H](C(=O)NCc1cocn1)C1(O)CCCCC1)c1ccnnc1
|
O=CN[C@H]C=O)NCccocn5))))))))CO)CCCCC6))))))))cccnnc6
|
[O][=C][Branch2][Ring1][=N][N][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C][C][=C][O][C][=N][Ring1][Branch1][C][Branch1][C][O][C][C][C][C][C][Ring1][#Branch1][C][=C][C][=N][N][=C][Ring1][=Branch1]
|
C18(O)CCCCC1.c16ccnnc1.[C@H]48C3=O.c17cocn1.O=C26.N24.N35.C57
|
C=CC[C@H](C(=O)N[C@@H](CN(C)C)C(=O)NCc1cscc1C)C(C)C
|
C=CC[C@H]C=O)N[C@@H]CNC)C)))C=O)NCccscc5C))))))))))))CC)C
|
[C][=C][C][C@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=C][S][C][=C][Ring1][Branch1][C][C][Branch1][C][C][C]
|
C=CC[C@H](C2=O)C(C)C.[C@H]4(C5)C3=O.c17cscc1C.N5(C)C.N24.N36.C67
|
CCNC(=O)[C@@]1(NC(=O)CCc2cnn(C)c2)CCC[C@H]1C
|
CCNC=O)[C@@]NC=O)CCccnnC)c5)))))))))CCC[C@H]5C
|
[C][C][N][C][=Branch1][C][=O][C@@][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][C][C@H1][Ring1][S][C]
|
[C@@]167CCC[C@H]1C.c18cnn(C)c1.C4(=O)CC8.C37=O.CC5.N35.N46
|
O=C(c1cccc2[nH]ccc12)N1CCOC[C@H](NS(=O)(=O)CCCl)C1
|
O=Cccccc[nH]ccc95)))))))))NCCOC[C@H]NS=O)=O)CCCl)))))C7
|
[O][=C][Branch1][=C][C][=C][C][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][N][C][C][O][C][C@H1][Branch1][N][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Cl][C][Ring1][=C]
|
c16cccc2[nH]ccc12.N13CCOC[C@H]5C1.S4(=O)(=O)CCCl.O=C36.N45
|
C[C@@H]1CCN(C(=O)[C@]2(CO)CC2(F)F)CCN1C(=O)c1ccncc1F
|
C[C@@H]CCNC=O)[C@]CO))CC3F)F)))))CCN7C=O)cccncc6F
|
[C][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@][Branch1][Ring1][C][O][C][C][Ring1][Branch1][Branch1][C][F][F][C][C][N][Ring1][S][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][F]
|
C[C@@H]1CCN3CCN14.c16ccncc1F.[C@@]157CC1(F)F.C35=O.C46=O.C7O
|
C[C@H](C(=O)NCCCN(C)c1nnc(-c2cccnc2)s1)c1ccccc1Cl
|
C[C@H]C=O)NCCCNC)cnnc-ccccnc6))))))s5)))))))))))cccccc6Cl
|
[C][C@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][S][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
|
c17ccccc1Cl.c16nnc8s1.c18cccnc1.C[C@@H]7C3=O.C4CC5.N56C.N34
|
C[C@@H]1CCCN(C(=O)c2cnnn2-c2cc(C(F)(F)F)ccc2Cl)[C@@H]1CCN
|
C[C@@H]CCCNC=O)ccnnn5-cccCF)F)F))ccc6Cl)))))))))))))[C@@H]6CCN
|
[C][C@@H1][C][C][C][N][Branch2][Ring1][#C][C][=Branch1][C][=O][C][=C][N][=N][N][Ring1][Branch1][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][Cl][C@@H1][Ring2][Ring1][Branch2][C][C][N]
|
C[C@@H]1CCCN3[C@@H]15.c17cc6ccc1Cl.c14cnnn17.C6(F)(F)F.C34=O.C5CN
|
C/C=C/C[C@@H](CC)C(=O)NCC1(C)CC(NC(=O)c2cc[nH]c2)C1
|
C/C=C/C[C@@H]CC))C=O)NCCC)CCNC=O)ccc[nH]c5)))))))C4
|
[C][/C][=C][/C][C@@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][C][Branch1][=N][N][C][=Branch1][C][=O][C][C][=C][NH1][C][=Ring1][Branch1][C][Ring1][=N]
|
C=8C[C@@H](CC)C3=O.C19(C)CC6C1.c17cc[nH]c1.C47=O.CC=8.N35.C59.N46
|
CC(Cl)=CC(=O)NC[C@@H]1[C@H](C)CCN1C(=O)[C@H]1CNC(=O)N1C
|
CCCl)=CC=O)NC[C@@H][C@H]C)CCN5C=O)[C@H]CNC=O)N5C
|
[C][C][Branch1][C][Cl][=C][C][=Branch1][C][=O][N][C][C@@H1][C@H1][Branch1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][N][Ring1][=Branch1][C]
|
[C@@H]17[C@H](C)CCN13.[C@H]15CNC(=O)N1C.C=6C2=O.CC=6Cl.C35=O.N24.C47
|
C[C@@]1(CCCC(=O)N2C[C@@H](NC(=O)C3(CCF)CC3)C3(CC3)C2)NC(=O)NC1=O
|
C[C@@]CCCC=O)NC[C@@H]NC=O)CCCF)))CC3)))))CCC3))C5)))))))))NC=O)NC5=O
|
[C][C@@][Branch2][Ring2][=Branch1][C][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][Branch1][Ring2][C][C][F][C][C][Ring1][=Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][S][N][C][=Branch1][C][=O][N][C][Ring2][Ring1][O][=O]
|
C[C@@]18NC(=O)NC1=O.N14C[C@@H]6C2(CC2)C1.C8CCC4=O.C179CC1.C57=O.C9CF.N56
|
CCOCCCCC(=O)N1CC(COC)(NC(=O)C#CC2(C)CC2)C1
|
CCOCCCCC=O)NCCCOC)))NC=O)C#CCC)CC3)))))))C4
|
[C][C][O][C][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][O][C][Branch1][S][N][C][=Branch1][C][=O][C][#C][C][Branch1][C][C][C][C][Ring1][Ring2][C][Ring1][S]
|
C4(=O)C#CC1(C)CC1.C6CCCC3=O.N13CC89C1.CC5.O56.C79.O7C.N48
|
CCCC[C@H](CC)C(=O)Nc1ccc(NC(=O)c2ccccc2[S@+](C)[O-])cc1C
|
CCCC[C@H]CC))C=O)NccccNC=O)cccccc6[S@+]C)[O-]))))))))))cc6C
|
[C][C][C][C][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S@+1][Branch1][C][C][O-1][C][=C][Ring2][Ring1][C][C]
|
CCCC[C@H](CC)C3=O.c17ccccc1[S@+](C)[O-].c15ccc6cc1C.C47=O.N35.N46
|
O=C(C1CC2(C1)CC(O)(C(F)(F)F)C2)N1CCNC[C@H]1c1ccccc1Cl
|
O=CCCCC4)CCO)CF)F)F))C4))))))NCCNC[C@H]6cccccc6Cl
|
[O][=C][Branch2][Ring1][O][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch1][C][O][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][#Branch2][N][C][C][N][C][C@H1][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
|
C14CC2(C1)CC5(O)C2.N13CCNC[C@H]16.c16ccccc1Cl.C5(F)(F)F.O=C34
|
CCOC(=O)c1n[nH]c(=NC[C@@H]2CCC[C@H]2NC(=O)Cn2nc(C)oc2=O)s1
|
CCOC=O)cn[nH]c=NC[C@@H]CCC[C@H]5NC=O)CnncC)oc5=O))))))))))))))))s5
|
[C][C][O][C][=Branch1][C][=O][C][=N][NH1][C][=Branch2][Ring1][O][=N][C][C@@H1][C][C][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][N][=C][Branch1][C][C][O][C][Ring1][=Branch1][=O][S][Ring2][Ring1][#Branch1]
|
c17n[nH]c(=NC9)s1.n18nc(C)oc1=O.[C@@H]19CCC[C@H]16.C4(=O)C8.C37=O.CC5.O35.N46
|
CCOC1CC(C(=O)NC[C@@H](NC(=O)C=CCO)C2CCCCC2)C1
|
CCOCCCC=O)NC[C@@H]NC=O)C=CCO))))))CCCCCC6))))))))))C4
|
[C][C][O][C][C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch2][N][C][=Branch1][C][=O][C][=C][C][O][C][C][C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1]
|
C1%11CCCCC1.C16CC9C1.C7[C@@H]8%11.C4(=O)C=%10.C39=O.C=%10CO.CC5.O56.N37.N48
|
CCCCn1nc(C(=O)N2CCN(C(=O)/C=C/[C@@H](C)CC)[C@@H](CF)C2)ccc1=O
|
CCCCnncC=O)NCCNC=O)/C=C/[C@@H]C)CC))))))[C@@H]CF))C6)))))))ccc6=O
|
[C][C][C][C][N][N][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][/C][=C][/C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][Ring1][C][F][C][Ring1][S][C][=C][C][Ring2][Ring1][Branch2][=O]
|
n17nc5ccc1=O.N13CCN4[C@@H]8C1.C=6[C@@H](C)CC.CCCC7.C4(=O)C=6.C35=O.C8F
|
CO[C@H]1C[C@@H](CNC(=O)CN(C)C(C)=O)N(C(=O)[C@H]2CCC[C@@H](C(C)(C)C)C2)C1
|
CO[C@H]C[C@@H]CNC=O)CNC)CC)=O)))))))NC=O)[C@H]CCC[C@@H]CC)C)C))C6)))))))C5
|
[C][O][C@H1][C][C@@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][Branch1][C][C][=O][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#Branch2][C][Ring2][Ring1][O]
|
[C@H]16C[C@@H]%10N5C1.[C@H]19CCC[C@@H]%11C1.C3(=O)C8.C%11(C)(C)C.N48C.C4(C)=O.C59=O.CO6.C7%10.N37
|
C#CC[C@H](CC(F)F)NC(=O)[C@@H](C)[C@@H]1CCN(C(=O)C(CCC)CCC)C1
|
C#CC[C@H]CCF)F)))NC=O)[C@@H]C)[C@@H]CCNC=O)CCCC)))CCC)))))C5
|
[C][#C][C][C@H1][Branch1][#Branch1][C][C][Branch1][C][F][F][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][Branch1][Ring2][C][C][C][C][C][C][C][Ring1][=C]
|
C3(=O)C(CCC)CCC.C#CC[C@@H]4CC(F)F.[C@@H]15CCN3C1.C2(=O)[C@H]5C.N24
|
CC(=O)N[C@@H](CC(=O)N[C@H]1CCN(C(=O)c2csc(C)n2)[C@H](C)C1)C(N)=O
|
CC=O)N[C@@H]CC=O)N[C@H]CCNC=O)ccscC)n5))))))[C@H]C)C6)))))))))CN)=O
|
[C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][C@H1][Branch1][C][C][C][Ring1][#C][C][Branch1][C][N][=O]
|
[C@H]6(CC4=O)C(N)=O.[C@H]17CCN5[C@H](C)C1.c18csc(C)n1.CC3=O.C58=O.N36.N47
|
C#CCCO[C@H](C)C(=O)Nc1cc(C#N)ccc1C
|
C#CCCO[C@H]C)C=O)NcccC#N))ccc6C
|
[C][#C][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][Ring1][C][#N][=C][C][=C][Ring1][Branch2][C]
|
c15cc(C#N)ccc1C.[C@@H]4(C)C2=O.C#CCC3.O34.N25
|
Cc1cc(C(=O)N[C@@H](C)CNC(=O)c2csc3c2C(C)(C)CCC3)sn1
|
CcccC=O)N[C@@H]C)CNC=O)ccscc5CC)C)CCC6)))))))))))))))sn5
|
[C][C][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Branch2][S][N][=Ring2][Ring1][=Branch2]
|
c19csc2c1C(C)(C)CCC2.Cc1cc8sn1.[C@H]6(C)C7.C48=O.C59=O.N46.N57
|
CSc1ccc(C(=O)N(C)CC2CN(C(=O)CC3(CO)CC3)C2)o1
|
CSccccC=O)NC)CCCNC=O)CCCO))CC3)))))C4)))))))o5
|
[C][S][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][O][C][C][Ring1][Branch1][C][Ring1][N][O][Ring2][Ring1][=Branch1]
|
c1%11ccc7o1.C18CN5C1.C5(=O)C9.C19%10CC1.C47=O.N46C.CS%11.C68.C%10O
|
COc1cc(Cl)cc(C(=O)N2CCN(C(=O)c3sccc3Br)C[C@@H]2CO)c1
|
COcccCl)ccC=O)NCCNC=O)csccc5Br)))))))C[C@@H]6CO)))))))))c6
|
[C][O][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][Br][C][C@@H1][Ring1][=C][C][O][=C][Ring2][Ring1][=Branch2]
|
c16cc8cc(Cl)c1.N14CCN5C[C@@H]19.c17sccc1Br.C48=O.C57=O.CO6.C9O
|
CN(CC(=O)N1CCN(C(=O)C=C2CCOCC2)[C@H]2CCC[C@]2(C)C1)C1CC1
|
CNCC=O)NCCNC=O)C=CCCOCC6))))))))[C@H]CCC[C@]5C)C%10))))))))))))CCC3
|
[C][N][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][O][C][C][Ring1][=Branch1][C@H1][C][C][C][C@][Ring1][Branch1][Branch1][C][C][C][Ring2][Ring1][Ring2][C][C][C][Ring1][Ring1]
|
N13CCN4[C@H]2CCC[C@]2(C)C1.C1=7CCOCC1.C5C3=O.C4(=O)C=7.CN56.C16CC1
|
Cc1cccc(NC(=O)[C@H]2CC23CCN(Cc2cnn(CC(C)C)c2)CC3)c1Cl
|
CcccccNC=O)[C@H]CC3CCNCccnnCCC)C)))c5))))))CC6))))))))))c6Cl
|
[C][C][=C][C][=C][C][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][N][Branch1][P][C][C][C][=N][N][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Ring1][=Branch2][C][C][Ring1][S][=C][Ring2][Ring1][O][Cl]
|
[C@H]17CC12CCN5CC2.Cc1cccc6c1Cl.c19cnn8c1.C8C(C)C.C47=O.N46.C59
|
C[C@@H](CNC(=O)COc1ccc(Br)cc1F)NC(=O)CN1CCCCC1=O
|
C[C@@H]CNC=O)COccccBr)cc6F))))))))))))NC=O)CNCCCCC6=O
|
[C][C@@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][F][N][C][=Branch1][C][=O][C][N][C][C][C][C][C][Ring1][=Branch1][=O]
|
c15ccc(Br)cc1F.N18CCCCC1=O.C[C@H]6C7.C2(=O)C4.C3(=O)C8.N27.O45.N36
|
Cc1nc2ccc(NC(=O)NC[C@@H]3COc4ccccc4O3)cc2o1
|
CcnccccNC=O)NC[C@@H]COcccccc6O%10))))))))))))))cc6o9
|
[C][C][=N][C][=C][C][=C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C@@H1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch1][O][Ring2][Ring1][Branch2]
|
Cc1nc2ccc8cc2o1.[C@@H]19COc2ccccc2O1.C56=O.N58.N67.C79
|
Cn1nccc1C[C@H]1CCN([C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2=O)C1
|
Cnnccc5C[C@H]CCN[C@@H]CCNcccccOCF)F)F)))c6))))))C5=O))))))C5
|
[C][N][N][=C][C][=C][Ring1][Branch1][C][C@H1][C][C][N][Branch2][Ring1][#C][C@@H1][C][C][N][Branch2][Ring1][Ring2][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][C][Ring1][S][=O][C][Ring2][Ring1][=Branch1]
|
[C@@H]15CCN8C1=O.c18cccc4c1.Cn1nccc16.[C@H]17CCN5C1.O4C(F)(F)F.C67
|
CCc1ccc(C(=O)NCCC[C@H](C)NC(=O)c2cc(F)cc(C)c2O)cn1
|
CCccccC=O)NCCC[C@H]C)NC=O)cccF)ccC)c6O)))))))))))))))cn6
|
[C][C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][C][=C][Ring1][Branch2][O][C][=N][Ring2][Ring1][#Branch2]
|
c18cc(F)cc(C)c1O.c19ccc7cn1.C5CC[C@@H]6C.C37=O.C48=O.CC9.N35.N46
|
CO[C@H](C)CCC(=O)NCCCCCCN(C)C(=O)CC(=O)N(C)C
|
CO[C@H]C)CCC=O)NCCCCCCNC)C=O)CC=O)NC)C
|
[C][O][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][Branch1][C][C][C]
|
[C@@H]4(C)CCC1=O.C5CCCCC6.C2(=O)CC3=O.N26C.N3(C)C.CO4.N15
|
CCN(C(=O)CCCC(F)(F)C(F)(F)F)[C@@H]1CCN(C(=O)C[C@@H]2CCNC2=O)C1
|
CCNC=O)CCCCF)F)CF)F)F)))))))[C@@H]CCNC=O)C[C@@H]CCNC5=O))))))))C5
|
[C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C@@H1][C][C][N][C][Ring1][Branch1][=O][C][Ring1][=C]
|
C3(=O)CCCC(F)(F)C(F)(F)F.[C@@H]16CCN4C1.[C@@H]17CCNC1=O.C4(=O)C7.N356.CC5
|
C=CCOCC(=O)N1C[C@H]2OCCN(C(=O)c3ccc(N)cc3F)[C@H]2C1
|
C=CCOCC=O)NC[C@H]OCCNC=O)ccccN)cc6F))))))))[C@H]6C9
|
[C][=C][C][O][C][C][=Branch1][C][=O][N][C][C@H1][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][F][C@H1][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14C[C@H]2OCCN5[C@H]2C1.c18ccc(N)cc1F.C7C4=O.C=CC6.C58=O.O67
|
CCCc1cc(C(=O)N(C)CCCCNC(=O)CS(=O)(=O)CC)ccn1
|
CCCcccC=O)NC)CCCCNC=O)CS=O)=O)CC))))))))))))ccn6
|
[C][C][C][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=N][Ring2][Ring1][#Branch1]
|
C3(=O)CS(=O)(=O)CC.c17cc6ccn1.C4CCC5.CCC7.C26=O.N24C.N35
|
CCC[C@H](NC(=O)c1cn(CC)nn1)[C@@H](O)C(=O)N1CCN(C)C[C@@H]1C1CC1
|
CCC[C@H]NC=O)ccnCC))nn5)))))))[C@@H]O)C=O)NCCNC)C[C@@H]6CCC3
|
[C][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][N][Branch1][Ring1][C][C][N][=N][Ring1][#Branch1][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][C@@H1][Ring1][#Branch1][C][C][C][Ring1][Ring1]
|
CCC[C@H]4[C@@H](O)C3=O.N13CCN(C)C[C@@H]17.c15cn6nn1.C25=O.C17CC1.N24.C6C
|
Cc1cc(Br)nc(NC(=O)c2ccc(NS(=O)(=O)c3ccc(F)cc3F)nc2)c1
|
CcccBr)ncNC=O)ccccNS=O)=O)ccccF)cc6F)))))))))nc6))))))))c6
|
[C][C][=C][C][Branch1][C][Br][=N][C][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][N][=C][Ring2][Ring1][C][=C][Ring2][Ring1][N]
|
S5(=O)(=O)c1ccc(F)cc1F.Cc1cc6nc(Br)c1.c18ccc7nc1.C48=O.N46.N57
|
CO[C@@H](CC1CCCCC1)C(=O)N1CC(n2cc(-c3cn(C)cn3)nn2)C1
|
CO[C@@H]CCCCCCC6)))))))C=O)NCCncc-ccnC)cn5)))))nn5)))))C4
|
[C][O][C@@H1][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][N][C][=C][Branch1][O][C][=C][N][Branch1][C][C][C][=N][Ring1][=Branch1][N][=N][Ring1][O][C][Ring1][#C]
|
[C@H]5(C6)C4=O.C16CCCCC1.n17cc8nn1.c18cn(C)cn1.N14CC7C1.CO5
|
Cc1cc(C2CC2)ccc1CN1C[C@H](C(=O)O)CC[C@H]1C(=O)O
|
CcccCCC3)))ccc6CNC[C@H]C=O)O))CC[C@H]6C=O)O
|
[C][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][C][=C][Ring1][=Branch2][C][N][C][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C@H1][Ring1][=Branch2][C][=Branch1][C][=O][O]
|
Cc1cc7ccc16.N13C[C@H]5CC[C@H]14.C17CC1.C5(=O)O.C4(=O)O.C36
|
COCCC(C)(C)C(=O)N1CC2(C[C@H](NC(=O)[C@@H](O)c3cncn3C)CO2)C1
|
COCCCC)C)C=O)NCCC[C@H]NC=O)[C@@H]O)ccncn5C)))))))))CO5))))C4
|
[C][O][C][C][C][Branch1][C][C][Branch1][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][C][O][C][=C][N][=C][N][Ring1][Branch1][C][C][O][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14CC2(C[C@H]7CO2)C1.C6CC(C)(C)C4=O.c18cncn1C.C5(=O)[C@H]8O.CO6.N57
|
CC(C)(C)[C@@H](NC(=O)c1cnn2c1OCC2)C(=O)N1CC[C@H]1C1CCCCC1
|
CCC)C)[C@@H]NC=O)ccnnc5OCC5))))))))))C=O)NCC[C@H]4CCCCCC6
|
[C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][O][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Ring1][Ring2][C][C][C][C][C][C][Ring1][=Branch1]
|
CC(C)(C)[C@@H]5C4=O.c16cnn2c1OCC2.C17CCCCC1.N14CC[C@H]17.C36=O.N35
|
CCOc1cccc2cc([C@H](C)NC(=O)NCC3CCC(S(C)(=O)=O)CC3)oc12
|
CCOccccccc[C@H]C)NC=O)NCCCCCSC)=O)=O))CC6)))))))))))oc95
|
[C][C][O][C][=C][C][=C][C][C][=C][Branch2][Ring1][=C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][#Branch2][O][C][Ring2][Ring1][#Branch2][=Ring2][Ring1][=Branch1]
|
c17cccc2cc%10oc12.C1%11CCC(S(C)(=O)=O)CC1.[C@@H]8%10C.C45=O.CC6.O67.N48.N59.C9%11
|
C[C@@H]1CC[C@H](CCC(=O)NC2(C3CN(C(=O)C4CCOCC4)C3)CC2)O1
|
C[C@@H]CC[C@H]CCC=O)NCCCNC=O)CCCOCC6)))))))C4))))CC3)))))))O5
|
[C][C@@H1][C][C][C@H1][Branch2][Ring2][Ring2][C][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][O][C][C][Ring1][=Branch1][C][Ring1][N][C][C][Ring1][#C][O][Ring2][Ring1][=Branch2]
|
C17(C2CN6C2)CC1.C[C@@H]1CC[C@H]9O1.C18CCOCC1.C9CC5=O.C68=O.N57
|
COC[C@H](C)C(=O)N1C[C@H](NC(=O)[C@@H]2C[C@@H]2[C@@H](C)O)C[C@@H]1C
|
COC[C@H]C)C=O)NC[C@H]NC=O)[C@@H]C[C@@H]3[C@@H]C)O)))))))C[C@@H]5C
|
[C][O][C][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C@@H1][Branch1][C][C][O][C][C@@H1][Ring1][=C][C]
|
N13C[C@H]6C[C@@H]1C.C5[C@H](C)C3=O.[C@@H]17C[C@@H]18.C47=O.[C@H]8(C)O.CO5.N46
|
CCc1ccc(C(=O)N[C@@H](C)C2(C(=O)NCc3cn[nH]c3)CC2)o1
|
CCccccC=O)N[C@@H]C)CC=O)NCccn[nH]c5))))))))CC3))))))o5
|
[C][C][C][=C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][=N][NH1][C][=Ring1][Branch1][C][C][Ring1][N][O][Ring2][Ring1][=Branch1]
|
c1%10ccc8o1.c1%12cn[nH]c1.C19%11CC1.C48=O.[C@@H]6%11C.C59=O.CC%10.N46.N57.C7%12
|
Cc1[nH]c2c(F)cccc2c1CCNC(=O)[C@@H](N)CN1CCCC1=O
|
Cc[nH]ccF)cccc6c9CCNC=O)[C@@H]N)CNCCCC5=O
|
[C][C][NH1][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][N][C][C][C][C][Ring1][Branch1][=O]
|
Cc1[nH]c2c(F)cccc2c16.C3(=O)[C@@H](N)C5.N15CCCC1=O.C6C4.N34
|
CC(=O)N1CC[C@H](CNC(=O)[C@@]2(NC(=O)[C@H](C)OCC3CC3)CCN(C)C2)C1
|
CC=O)NCC[C@H]CNC=O)[C@@]NC=O)[C@H]C)OCCCC3))))))))CCNC)C5))))))))C5
|
[C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring2][Ring1][C][N][C][=Branch1][C][=O][C@@][Branch1][P][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][O][C][C][C][C][Ring1][Ring1][C][C][N][Branch1][C][C][C][Ring1][S][C][Ring2][Ring1][=Branch2]
|
[C@@]1%11%12CCN(C)C1.N14CC[C@H]%13C1.C7(=O)[C@@H]8C.CC4=O.C6%12=O.C15CC1.C%10%13.N6%10.N7%11.O89.C95
|
C#CCCCCCCCNC(=O)[C@@H]1C[C@@]12CCN(C(=O)CCc1cccnc1)C2
|
C#CCCCCCCCNC=O)[C@@H]C[C@@]3CCNC=O)CCccccnc6)))))))))C5
|
[C][#C][C][C][C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@@][Ring1][Ring1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][#C]
|
C#CCCCCCCC5.[C@@H]16C[C@@]12CCN4C2.c17cccnc1.C4(=O)CC7.C36=O.N35
|
Cc1cc(CNC[C@@]23C[C@@H]2CN(C(=O)c2ccccc2I)C3)ccc1Br
|
CcccCNC[C@@]C[C@@H]3CNC=O)cccccc6I))))))))C6)))))))))ccc6Br
|
[C][C][=C][C][Branch2][Ring1][=N][C][N][C][C@@][C][C@@H1][Ring1][Ring1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][I][C][Ring1][#C][=C][C][=C][Ring2][Ring1][Branch2][Br]
|
Cc1cc9ccc1Br.[C@@]128C[C@@H]1CN4C2.c17ccccc1I.C47=O.C59.N56.C68
|
O=C(NC[C@@H]1[C@H]2CN(C(=O)C[C@]3(O)CCCOC3)C[C@@H]12)c1cn(CC2CC2)nn1
|
O=CNC[C@@H][C@H]CNC=O)C[C@]O)CCCOC6))))))))C[C@@H]65))))))))ccnCCCC3))))nn5
|
[O][=C][Branch2][Ring1][#C][N][C][C@@H1][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C@][Branch1][C][O][C][C][C][O][C][Ring1][#Branch1][C][C@@H1][Ring1][S][Ring1][#C][C][=C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][=N][Ring1][=Branch2]
|
[C@@H]19[C@H]2CN5C[C@@H]12.[C@@]1%10(O)CCCOC1.c17cn8nn1.C5(=O)C%10.O=C47.C1%11CC1.N46.C69.C8%11
|
CSCCCC(=O)NCCOC1CN(C(=O)[C@@H]2CCc3n[nH]cc3C2)C1
|
CSCCCC=O)NCCOCCNC=O)[C@@H]CCcn[nH]cc5C9))))))))))C4
|
[C][S][C][C][C][C][=Branch1][C][=O][N][C][C][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C][C][C][=N][NH1][C][=C][Ring1][Branch1][C][Ring1][=Branch2][C][Ring1][#C]
|
[C@@H]1%10CCc2n[nH]cc2C1.C9CCC4=O.C17CN5C1.C8C6.C5%10=O.CS9.N48.O67
|
CO[C@]1(C(=O)NC[C@H]2C[C@H](NC(=O)C3=CCCCO3)C2)CCCC(C)(C)C1
|
CO[C@]C=O)NC[C@H]C[C@H]NC=O)C=CCCCO6))))))))C4)))))))CCCCC)C)C6
|
[C][O][C@][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][C][C][O][Ring1][=Branch1][C][Ring1][=N][C][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][=Branch2]
|
[C@@]169CCCC(C)(C)C1.C5(=O)C1=CCCCO1.[C@H]1%10C[C@H]8C1.C49=O.CO6.N47.C7%10.N58
|
O=C(NCC(=O)N1CCOc2ccccc21)c1cc(-c2ccccc2Cl)on1
|
O=CNCC=O)NCCOcccccc6%10)))))))))))))ccc-cccccc6Cl)))))))on5
|
[O][=C][Branch2][Ring1][Branch1][N][C][C][=Branch1][C][=O][N][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][C][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][O][N][=Ring1][N]
|
N14CCOc2ccccc21.c17ccccc1Cl.c16cc7on1.C5C4=O.O=C36.N35
|
CC1(C)CC2(CC(NC(=O)[C@@H]3C[C@H](NC(=O)[C@H](O)CC(F)(F)F)C34CCC4)C2)C1
|
CCC)CCCCNC=O)[C@@H]C[C@H]NC=O)[C@H]O)CCF)F)F))))))C4CCC4)))))))))C4)))C4
|
[C][C][Branch1][C][C][C][C][Branch2][Ring2][#C][C][C][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=C][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Branch2][C][Ring2][Ring1][N]
|
CC1(C)CC2(CC7C2)C1.C6(=O)[C@H](O)CC(F)(F)F.[C@@H]19C[C@H]8C12CCC2.C59=O.N57.N68
|
CC=C[C@H](O)C(=O)N1CC[C@H](CNC(=O)CCc2csc3ccccc23)C12CC2
|
CC=C[C@H]O)C=O)NCC[C@H]CNC=O)CCccscccccc96))))))))))))))C5CC3
|
[C][C][=C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][C][=C][S][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][Ring2][Ring1][Ring2][C][C][Ring1][Ring1]
|
c19csc2ccccc12.N14CC[C@H]8C12CC2.C=7[C@H](O)C4=O.C5(=O)CC9.CC=7.C68.N56
|
O=C(N[C@@H]1CN(C(=O)Cc2csnn2)CC12CCS(=O)(=O)CC2)c1ccco1
|
O=CN[C@@H]CNC=O)Cccsnn5)))))))CC5CCS=O)=O)CC6)))))))))))cccco5
|
[O][=C][Branch2][Ring2][Ring2][N][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=C][S][N][=N][Ring1][Branch1][C][C][Ring1][=N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][Branch2][C][=C][C][=C][O][Ring1][Branch1]
|
[C@@H]15CN4CC12CCS(=O)(=O)CC2.c17csnn1.c16ccco1.C4(=O)C7.O=C36.N35
|
C[C@H](CN(C)C(=O)c1cn(C)ccc1=O)C(=O)NC[C@H]1C[C@H]2O[C@@H]1[C@@H]1C[C@@H]12
|
C[C@H]CNC)C=O)ccnC)ccc6=O))))))))))C=O)NC[C@H]C[C@H]O[C@@H]5[C@@H]C[C@@H]36
|
[C][C@H1][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][N][Branch1][C][C][C][=C][C][Ring1][#Branch1][=O][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][O][C@@H1][Ring1][Branch1][C@@H1][C][C@@H1][Ring1][Ring1][Ring1][=Branch1]
|
c17cn(C)ccc1=O.[C@H]18C[C@H]2O[C@@H]1[C@@H]1C[C@@H]12.C[C@H](C5)C4=O.N35C.C37=O.N46.C68
|
O=C(N[C@@H]1CN(C(=O)[C@H](F)CC2CCC2)CC[C@H]1CO)c1cc(C2CC2)ncn1
|
O=CN[C@@H]CNC=O)[C@H]F)CCCCC4)))))))CC[C@H]6CO)))))))))cccCCC3)))ncn6
|
[O][=C][Branch2][Ring1][=N][N][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][C][C][C][C][Ring1][Ring2][C][C][C@H1][Ring1][#C][C][O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=N][Ring1][=Branch2]
|
[C@@H]15CN4CC[C@H]18.c16cc9ncn1.C4(=O)[C@H](F)C7.C17CCC1.O=C36.C19CC1.N35.C8O
|
O=C(N[C@@H]1CN(C(=O)CC2OCCCO2)C[C@@H]1F)C1=C[C@]2(CCOC2)C1
|
O=CN[C@@H]CNC=O)CCOCCCO6))))))))C[C@@H]5F)))))))C=C[C@]CCOC5))))C4
|
[O][=C][Branch2][Ring1][=Branch2][N][C@@H1][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][O][C][C][C][O][Ring1][=Branch1][C][C@@H1][Ring1][=C][F][C][=C][C@][Branch1][#Branch1][C][C][O][C][Ring1][Branch1][C][Ring1][Branch2]
|
O=C3C1=C[C@]2(CCOC2)C1.[C@@H]15CN4C[C@@H]1F.C16OCCCO1.C4(=O)C6.N35
|
CCCCO[C@H](C)C(=O)N[C@H]1C[C@@H](CCC(=O)N(OC)[C@@H](C)CC)C1
|
CCCCO[C@H]C)C=O)N[C@H]C[C@@H]CCC=O)NOC))[C@@H]C)CC)))))))C4
|
[C][C][C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch2][Ring1][C][C][C][C][=Branch1][C][=O][N][Branch1][Ring1][O][C][C@@H1][Branch1][C][C][C][C][C][Ring1][#C]
|
C6CC(=O)N(OC)[C@@H](C)CC.[C@@H]4(C)C2=O.[C@H]15C[C@@H]6C1.CCCC3.O34.N25
|
CC[C@@H](NCCOCCOCCF)[C@@H]1CCOC1
|
CC[C@@H]NCCOCCOCCF))))))))))[C@@H]CCOC5
|
[C][C][C@@H1][Branch1][O][N][C][C][O][C][C][O][C][C][F][C@@H1][C][C][O][C][Ring1][Branch1]
|
[C@@H]18CCOC1.CC[C@@H]68.C7C2.C3C4.C5CF.N67.O23.O45
|
COCc1cc(C(=O)NCC(=O)N2CC[C@@H]3CN(C)C[C@@H]3C2)on1
|
COCcccC=O)NCC=O)NCC[C@@H]CNC)C[C@@H]5C9)))))))))))))on5
|
[C][O][C][C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][N][Branch1][C][C][C][C@@H1][Ring1][=Branch1][C][Ring1][#Branch2][O][N][=Ring2][Ring1][Branch1]
|
N15CC[C@@H]2CN(C)C[C@@H]2C1.c19cc8on1.C7C5=O.C48=O.CO6.C69.N47
|
COCC(C)=CC(=O)N(C1CC1)C1(C(=O)N[C@@H](C)C2CCC2)CCC1
|
COCCC)=CC=O)NCCC3)))CC=O)N[C@@H]C)CCCC4)))))))CCC4
|
[C][O][C][C][Branch1][C][C][=C][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Branch1][S][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][C][Ring1][Ring2][C][C][C][Ring1][=N]
|
C169CCC1.C5C=%10C.C=%10C3=O.C1%11CCC1.N368.C18CC1.C49=O.[C@@H]7%11C.CO5.N47
|
C[C@@H]1CCN(C(=O)c2cnc3cccnc3c2)C[C@H]1CNC(=O)[C@@H]1COC(=O)O1
|
C[C@@H]CCNC=O)ccnccccnc6c%10)))))))))))C[C@H]6CNC=O)[C@@H]COC=O)O5
|
[C][C@@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][=C][C][=C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C@H1][Ring2][Ring1][C][C][N][C][=Branch1][C][=O][C@@H1][C][O][C][=Branch1][C][=O][O][Ring1][=Branch1]
|
c18cnc2cccnc2c1.C[C@@H]1CCN4C[C@H]19.[C@@H]17COC(=O)O1.C48=O.C57=O.C69.N56
|
CC[C@@H](C)n1nc(C(=O)NOCc2cn([C@@H]3CCN(C)C3=O)nn2)cc1C
|
CC[C@@H]C)nncC=O)NOCccn[C@@H]CCNC)C5=O))))))nn5)))))))))cc5C
|
[C][C][C@@H1][Branch1][C][C][N][N][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][O][C][C][=C][N][Branch1][N][C@@H1][C][C][N][Branch1][C][C][C][Ring1][=Branch1][=O][N][=N][Ring1][N][C][=C][Ring2][Ring1][=Branch1][C]
|
n16nc5cc1C.[C@@H]18CCN(C)C1=O.c17cn8nn1.C5(=O)NO4.CC[C@H]6C.C47
|
CC[C@](C)(COC)NC(=O)[C@H](O)CNC(=O)[C@H]1CC[C@@H](O)CN1C
|
CC[C@]C)COC)))NC=O)[C@H]O)CNC=O)[C@H]CC[C@@H]O)CN6C
|
[C][C][C@][Branch1][C][C][Branch1][Ring2][C][O][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C@H1][C][C][C@@H1][Branch1][C][O][C][N][Ring1][#Branch1][C]
|
[C@H]17CC[C@@H](O)CN1C.CC[C@]5(C)C4.C2(=O)[C@H](O)C6.C37=O.O4C.N25.N36
|
Cc1ccc(F)c(C(=O)N(C)CCNC(=O)Cc2ccsn2)n1
|
CccccF)cC=O)NC)CCNC=O)Ccccsn5))))))))))))n6
|
[C][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][C][C][=C][S][N][=Ring1][Branch1][=N][Ring2][Ring1][=Branch1]
|
Cc1ccc(F)c7n1.c18ccsn1.C4(=O)C8.C37=O.N35C.C5C6.N46
|
O=C(COc1ccccc1F)NNC(=O)[C@@H]1CCc2nnn(C3CCC3)c2C1
|
O=CCOcccccc6F)))))))))NNC=O)[C@@H]CCcnnnCCCC4))))c5C9
|
[O][=C][Branch1][N][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][=N][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][C][=Ring1][=Branch2][C][Ring1][=N]
|
[C@@H]16CCc2nnn7c2C1.O=C(C4)NNC6=O.c15ccccc1F.C17CCC1.O45
|
COc1ccc([C@H]2CCCN2CC(=O)c2cc(F)c(F)c(F)c2)cc1C
|
COcccc[C@H]CCCN5CC=O)cccF)cF)cF)c6)))))))))))))cc6C
|
[C][O][C][=C][C][=C][Branch2][Ring1][=C][C@H1][C][C][C][N][Ring1][Branch1][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][#Branch1][C]
|
c15cc(F)c(F)c(F)c1.c13ccc6cc1C.[C@H]16CCCN14.C4C5=O.CO3
|
CCN(C(=O)c1nc(Cl)cs1)[C@H](C)C(=O)Nc1ccc2c(c1)CCC2
|
CCNC=O)cncCl)cs5))))))[C@H]C)C=O)Ncccccc6)CCC5
|
[C][C][N][Branch1][#C][C][=Branch1][C][=O][C][=N][C][Branch1][C][Cl][=C][S][Ring1][=Branch1][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1]
|
c17ccc2c(c1)CCC2.c18nc(Cl)cs1.[C@@H]6(C)C4=O.N356.C38=O.CC5.N47
|
Cc1cc2nccnc2cc1C(=O)N1CCCN(C(=O)[C@H](O)C(C)(C)C)[C@@H](C)C1
|
Ccccnccnc6cc%10C=O)NCCCNC=O)[C@H]O)CC)C)C))))[C@@H]C)C7
|
[C][C][=C][C][=N][C][=C][N][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Branch1][C][C][C][Ring1][S]
|
Cc1cc2nccnc2cc15.N13CCCN4[C@@H](C)C1.C4(=O)[C@H](O)C(C)(C)C.C35=O
|
C#C[C@H](C)N(CCCC)[C@H](C(=O)N[C@H](C)C(=O)OC)c1cc2cccc(Cl)c2o1
|
C#C[C@H]C)NCCCC))))[C@H]C=O)N[C@H]C)C=O)OC))))))cccccccCl)c6o9
|
[C][#C][C@H1][Branch1][C][C][N][Branch1][Branch1][C][C][C][C][C@H1][Branch1][S][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][O][Ring1][#Branch2]
|
c19cc2cccc(Cl)c2o1.[C@H]79C4=O.[C@@H]8(C)C3=O.C#C[C@@H]5C.C6CCC.N567.N48.O3C
|
CN(C(=O)c1cnsc1)[C@@H]1CCCN(C(=O)C2=CCc3ccccc32)C1
|
CNC=O)ccnsc5))))))[C@@H]CCCNC=O)C=CCcccccc69))))))))))C6
|
[C][N][Branch1][N][C][=Branch1][C][=O][C][C][=N][S][C][=Ring1][Branch1][C@@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][Ring1][P]
|
C5(=O)C1=CCc2ccccc21.[C@@H]16CCCN5C1.c17cnsc1.CN46.C47=O
|
Cc1cnn([C@@H](C)C(=O)NC[C@H]2C[C@@H](C(=O)NCCC(F)(F)F)C2)c1
|
Cccnn[C@@H]C)C=O)NC[C@H]C[C@@H]C=O)NCCCF)F)F))))))C4))))))))c5
|
[C][C][C][=N][N][Branch2][Ring2][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=N][C][=Ring2][Ring1][Branch2]
|
Cc1cnn8c1.C6CC(F)(F)F.[C@H]8(C)C3=O.[C@H]19C[C@@H]7C1.C47=O.N35.C59.N46
|
CCOC(=O)Cn1c(C)cc(C(=O)NC[C@H]2c3ccccc3CCN2C)c1C
|
CCOC=O)CncC)ccC=O)NC[C@H]cccccc6CCN%10C))))))))))))))c5C
|
[C][C][O][C][=Branch1][C][=O][C][N][C][Branch1][C][C][=C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch1][C]
|
C7[C@H]1c2ccccc2CCN1C.n19c(C)cc8c1C.C4(=O)C9.C58=O.CC6.O46.N57
|
COc1cc2c(=O)c(C(=O)N[C@@H]3CCCC[C@@H]3C)c[nH]c2cc1Br
|
COcccc=O)cC=O)N[C@@H]CCCC[C@@H]6C)))))))))c[nH]c6cc%10Br
|
[C][O][C][=C][C][C][=Branch1][C][=O][C][Branch1][#C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][=C][NH1][C][=Ring1][P][C][=C][Ring2][Ring1][Branch1][Br]
|
c15cc2c(=O)c7c[nH]c2cc1Br.[C@@H]16CCCC[C@@H]1C.C47=O.CO5.N46
|
CCC(CC)(CNC(=O)[C@H](C)SC)NC(=O)c1ccc(Cl)c(OC)c1N
|
CCCCC))CNC=O)[C@H]C)SC))))))NC=O)ccccCl)cOC))c6N
|
[C][C][C][Branch1][Ring1][C][C][Branch1][=N][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2][N]
|
c18ccc(Cl)c4c1N.CCC5(C6)CC.C2(=O)[C@@H]7C.C38=O.N26.S7C.N35.O4C
|
O=C1CC[C@H](C(=O)NC2(CCC(=O)N3CC[C@@H]4C[C@H]4C3)CCC2)O1
|
O=CCC[C@H]C=O)NCCCC=O)NCC[C@@H]C[C@H]3C7))))))))))CCC4))))))O5
|
[O][=C][C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][Branch2][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C@H1][Ring1][Ring1][C][Ring1][#Branch1][C][C][C][Ring1][#C][O][Ring2][Ring1][#Branch1]
|
N16CC[C@@H]2C[C@H]2C1.O=C1CC[C@H]8O1.C179CCC1.C9CC6=O.C58=O.N57
|
Cc1[nH]nc(Cl)c1C(=O)N1CC2(C1)CN(C(=O)[C@@H](C)CS(C)(=O)=O)CC(C)(C)O2
|
Cc[nH]ncCl)c5C=O)NCCC4)CNC=O)[C@@H]C)CSC)=O)=O)))))CCC)C)O6
|
[C][C][NH1][N][=C][Branch1][C][Cl][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Branch1][C][C][Branch1][C][C][O][Ring2][Ring1][C]
|
N13CC2(C1)CN4CC(C)(C)O2.C4(=O)[C@@H](C)CS(C)(=O)=O.Cc1[nH]nc(Cl)c15.C35=O
|
CC[C@@](C)(CO)C(=O)N(C)CC(C)(C)NC(=O)C[C@@H](c1cccc(F)c1)C(F)F
|
CC[C@@]C)CO))C=O)NC)CCC)C)NC=O)C[C@@H]cccccF)c6))))))CF)F
|
[C][C][C@@][Branch1][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Branch1][C][F][F]
|
CC[C@@](C)(CO)C2=O.C3(=O)C[C@@H]6C(F)F.c16cccc(F)c1.C4C5(C)C.N24C.N35
|
C[C@H](CNC(=O)C1(c2cccs2)CC1)NC(=O)COCc1cccnc1
|
C[C@H]CNC=O)Cccccs5)))))CC3))))))NC=O)COCccccnc6
|
[C][C@H1][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][Branch2][N][C][=Branch1][C][=O][C][O][C][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
c1%10cccnc1.c1%11cccs1.C[C@@H]7C8.C19%11CC1.C4(=O)C5.C39=O.N38.N47.O56.C6%10
|
C#CC[C@]1(C(=O)N2CC[C@@H](C)[C@H](NC(=O)c3cnc4c(c3)CCC4)C2)CCOC1
|
C#CC[C@]C=O)NCC[C@@H]C)[C@H]NC=O)ccnccc6)CCC5))))))))))C6)))))))CCOC5
|
[C][#C][C][C@][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][C][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][N][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C][C][O][C][Ring2][Ring1][#Branch2]
|
c19cnc2c(c1)CCC2.N15CC[C@@H](C)[C@H]7C1.[C@]18%10CCOC1.C#CC%10.C58=O.C69=O.N67
|
CC[C@@H](O)CC(=O)N[C@H](CC)CNC(=O)c1cnc2ncccn12
|
CC[C@@H]O)CC=O)N[C@H]CC))CNC=O)ccncncccn96
|
[C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][C][C][N][C][=Branch1][C][=O][C][=C][N][=C][N][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1]
|
c17cnc2ncccn12.CC[C@@H](O)CC3=O.[C@H]5(C6)CC.C47=O.N35.N46
|
CCCCNC(=O)[C@@H](c1cc(COC)cs1)N1C[C@H]2OCCC[C@@]2(CO)C1
|
CCCCNC=O)[C@@H]cccCOC)))cs5)))))NC[C@H]OCCC[C@@]6CO))C9
|
[C][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][=N][C][=C][C][Branch1][Ring2][C][O][C][=C][S][Ring1][Branch2][N][C][C@H1][O][C][C][C][C@@][Ring1][=Branch1][Branch1][Ring1][C][O][C][Ring1][O]
|
N16C[C@H]2OCCC[C@@]28C1.c17cc9cs1.C3(=O)[C@H]67.CCCC5.N35.C49.O4C.C8O
|
CC=CC=CC(=O)N1CC[C@@](F)(CNC(=O)c2ccc3nnn(C)c3n2)C1
|
CC=CC=CC=O)NCC[C@@]F)CNC=O)ccccnnnC)c5n9))))))))))))C5
|
[C][C][=C][C][=C][C][=Branch1][C][=O][N][C][C][C@@][Branch1][C][F][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=N][N][Branch1][C][C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][Ring2][Ring1][Ring2]
|
c17ccc2nnn(C)c2n1.N14CC[C@]%10(F)C1.C=9C4=O.C=8C=9.C57=O.CC=8.C6%10.N56
|
CC(C)(C(=O)N1CC[C@@]2(CO)CN(C(=O)CC3CCC3)C[C@H]2C1)n1cccn1
|
CCC)C=O)NCC[C@@]CO))CNC=O)CCCCC4))))))C[C@H]5C9))))))))))ncccn5
|
[C][C][Branch1][C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C][C@@][Branch1][Ring1][C][O][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][C][C@H1][Ring1][=C][C][Ring2][Ring1][C][N][C][=C][C][=N][Ring1][Branch1]
|
N14CC[C@@]27CN5C[C@H]2C1.CC6(C)C4=O.n16cccn1.C5(=O)C8.C18CCC1.C7O
|
O=C(Nc1ccc2c(C(=O)Nc3cccc(CO)c3)ncn2c1)c1ccns1
|
O=CNcccccC=O)NcccccCO))c6))))))))ncn5c9))))))))))cccns5
|
[O][=C][Branch2][Ring2][Ring2][N][C][C][=C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][Ring1][C][O][=C][Ring1][Branch2][N][=C][N][Ring1][S][C][=Ring2][Ring1][Ring2][C][=C][C][=N][S][Ring1][Branch1]
|
c16ccc2c9ncn2c1.c17cccc%10c1.c18ccns1.O=C48.C59=O.N46.N57.C%10O
|
N#Cc1ccnc(C(=O)NC23CC(NC(=O)c4cnc5ccoc5c4)(C2)C3)c1F
|
N#CcccncC=O)NCCCNC=O)ccncccoc5c9)))))))))))C4)C4))))))c6F
|
[N][#C][C][=C][C][=N][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][O][C][Ring1][Branch1][=C][Ring1][=Branch2][Branch1][Ring2][C][Ring1][S][C][Ring1][P][=C][Ring2][Ring1][#Branch2][F]
|
N#Cc1ccnc%10c1F.c1%11cnc2ccoc2c1.C128CC9(C1)C2.C6%10=O.C7%11=O.N68.N79
|
C=CC(C)(C)C(=O)N1CCC[C@H](C(=O)NCCNC(=O)c2ccc(C)c(C)n2)C1
|
C=CCC)C)C=O)NCCC[C@H]C=O)NCCNC=O)ccccC)cC)n6))))))))))))C6
|
[C][=C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=N][Ring1][Branch2][C][Ring2][Ring1][=Branch1]
|
c18ccc(C)c(C)n1.C=CC(C)(C)C3=O.N13CCC[C@H]9C1.C49=O.C6C7.C58=O.N46.N57
|
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