SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
CCC1(C(=O)N(C2CC2)[C@H](C)C(=O)N2CCOC[C@@H](C)C2)CCOCC1
|
CCCC=O)NCCC3)))[C@H]C)C=O)NCCOC[C@@H]C)C7)))))))))))CCOCC6
|
[C][C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Branch1][C][C][C][Ring1][Branch2][C][C][O][C][C][Ring2][Ring1][Branch2]
|
N14CCOC[C@@H](C)C1.C178CCOCC1.[C@@H]5(C)C4=O.C37=O.N356.C16CC1.CC8
|
CCN(CC)CCSCC(=O)N1C[C@H](NC(=O)[C@@](C)(CC)C(N)=O)CC(C)(C)C1
|
CCNCC))CCSCC=O)NC[C@H]NC=O)[C@@]C)CC))CN)=O)))))CCC)C)C6
|
[C][C][N][Branch1][Ring1][C][C][C][C][S][C][C][=Branch1][C][=O][N][C][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch1][Ring1][C][C][C][Branch1][C][N][=O][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][C]
|
N12C[C@H]9CC(C)(C)C1.C3(=O)[C@@](C)(CC)C(N)=O.C8C2=O.N456.C6C7.CC4.C5C.S78.N39
|
Cc1nn(CCO)c(C(F)F)c1C(=O)N1CC(O)(CNC(=O)C[C@@H](C)CF)C1
|
CcnnCCO)))cCF)F))c5C=O)NCCO)CNC=O)C[C@@H]C)CF)))))))C4
|
[C][C][=N][N][Branch1][Ring2][C][C][O][C][Branch1][=Branch1][C][Branch1][C][F][F][=C][Ring1][O][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][=C][C][N][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][F][C][Ring1][=C]
|
Cc1nn6c7c15.C3(=O)C[C@@H](C)CF.N12CC8(O)C1.C6CO.C7(F)F.C25=O.C48.N34
|
Cc1ncc(Br)cc1C(=O)N1CCO[C@@H](C(=O)Nc2cn3c(Br)cccc3n2)C1
|
CcnccBr)cc6C=O)NCCO[C@@H]C=O)NccncBr)cccc6n9)))))))))))C6
|
[C][C][=N][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][O][C@@H1][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][N][C][Branch1][C][Br][=C][C][=C][C][Ring1][#Branch1][=N][Ring1][#Branch2][C][Ring2][Ring1][Ring1]
|
c16cn2c(Br)cccc2n1.Cc1ncc(Br)cc18.N14CCO[C@@H]7C1.C48=O.C57=O.N56
|
C=C[C@](C)(O)CC(=O)N1CCCC[C@@H]1CCNC(=O)C(F)(F)CCn1ccnn1
|
C=C[C@]C)O)CC=O)NCCCC[C@@H]6CCNC=O)CF)F)CCnccnn5
|
[C][=C][C@][Branch1][C][C][Branch1][C][O][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][C][N][C][=C][N][=N][Ring1][Branch1]
|
C=C[C@](C)(O)CC2=O.C3(=O)C(F)(F)CC5.N12CCCC[C@@H]16.n15ccnn1.C6C4.N34
|
Cc1cc(C(=O)N(C)C[C@H](C)NC(=O)C2=C[C@@H](C)CC2)c2cccc(C)c2n1
|
CcccC=O)NC)C[C@H]C)NC=O)C=C[C@@H]C)CC5)))))))))))cccccC)c6n%10
|
[C][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][Branch1][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C@@H1][Branch1][C][C][C][C][Ring1][=Branch1][=C][C][=C][C][=C][Branch1][C][C][C][Ring1][#Branch1][=N][Ring2][Ring1][O]
|
Cc1cc7c2cccc(C)c2n1.C4(=O)C1=C[C@@H](C)CC1.C5[C@@H]6C.C37=O.N35C.N46
|
CC(C)(C)[C@H](CO)C(=O)N[C@]1(C)C[C@@H](NC(=O)Cc2ccc3ccoc3c2)C1
|
CCC)C)[C@H]CO))C=O)N[C@]C)C[C@@H]NC=O)Cccccccoc5c9))))))))))))C4
|
[C][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@][Branch1][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][O][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring2][Ring1][C]
|
CC(C)(C)[C@H](CO)C4=O.c18ccc2ccoc2c1.[C@]16(C)C[C@H]7C1.C5(=O)C8.N46.N57
|
CC(C)(C)OC(=O)N1CSCC[C@@H]1C(=O)NC/C=C/CNC(=O)C1CC(F)(F)C1
|
CCC)C)OC=O)NCSCC[C@@H]6C=O)NC/C=C/CNC=O)CCCF)F)C4
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][S][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][/C][=C][/C][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1]
|
N14CSCC[C@@H]1%10.C1%11CC(F)(F)C1.CC7(C)C.C24=O.C5%10=O.C8C=3.C=3C9.C6%11=O.O27.N58.N69
|
CC(=O)c1ccc(NC(=O)C(=O)N(C)CCCCCCN)cc1C
|
CC=O)ccccNC=O)C=O)NC)CCCCCCN)))))))))))cc6C
|
[C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][C][C][N][C][=C][Ring2][Ring1][Ring2][C]
|
c16ccc5cc1C.C4CCCCCN.C2(=O)C3=O.CC6=O.N34C.N25
|
CCN(CCCNC(=O)[C@H](C(C)C)n1cc(C)cn1)C(=O)[C@H](C#N)C(C)C
|
CCNCCCNC=O)[C@H]CC)C))nccC)cn5)))))))))))C=O)[C@H]C#N))CC)C
|
[C][C][N][Branch2][Ring1][O][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=C][Branch1][C][C][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][#N][C][Branch1][C][C][C]
|
C3(=O)[C@H](C#N)C(C)C.C2(=O)[C@@H]7C(C)C.n17cc(C)cn1.C5CC6.N345.CC4.N26
|
CN(C(=O)C(C)(C)c1ccc(F)cc1)C1CN(C(=O)C2=NO[C@H](C(C)(C)C)C2)C1
|
CNC=O)CC)C)ccccF)cc6))))))))CCNC=O)C=NO[C@H]CC)C)C))C5))))))C4
|
[C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=N][O][C@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=Branch2][C][Ring1][#C]
|
C4(=O)C1=NO[C@H]6C1.c17ccc(F)cc1.C3(=O)C7(C)C.C15CN4C1.C6(C)(C)C.CN35
|
CN1CC=C(CC(=O)N2CCCCC[C@@H](NC(=O)[C@@H]3CC(=O)NC3(C)C)C2)CC1
|
CNCC=CCC=O)NCCCCC[C@@H]NC=O)[C@@H]CC=O)NC5C)C))))))))C8))))))))))CC6
|
[C][N][C][C][=C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@H1][C][C][=Branch1][C][=O][N][C][Ring1][=Branch1][Branch1][C][C][C][C][Ring2][Ring1][Ring1][C][C][Ring2][Ring1][N]
|
CN1CC=C(CC4=O)CC1.N14CCCCC[C@@H]6C1.[C@@H]17CC(=O)NC1(C)C.C57=O.N56
|
CCN(C(=O)C=CC1(C)COC1)[C@@H](C)C(=O)NCCC1CC1
|
CCNC=O)C=CCC)COC4)))))))[C@@H]C)C=O)NCCCCC3
|
[C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][C][O][C][Ring1][Branch1][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Ring1]
|
C=7C1(C)COC1.[C@H]5(C)C3=O.C2(=O)C=7.N245.C6C8.C18CC1.CC4.N36
|
CCN(CCNC(=O)C1(CNC(=O)[C@@H](C)COC)CCCCC1)C1CC1
|
CCNCCNC=O)CCNC=O)[C@@H]C)COC)))))))CCCCC6))))))))))CCC3
|
[C][C][N][Branch2][Ring1][#C][C][C][N][C][=Branch1][C][=O][C][Branch1][=C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][O][C][C][C][C][C][C][Ring1][#C][C][C][C][Ring1][Ring1]
|
C1%113CCCCC1.C4(=O)[C@@H](C)C5.N67%10.C7C8.C2%11=O.C1%10CC1.CC6.N28.C93.N49.O5C
|
COCc1ncc(C(=O)N[C@H]2CCN(C(=O)[C@]3(F)C[C@H]3C)CC23CCC3)s1
|
COCcnccC=O)N[C@H]CCNC=O)[C@]F)C[C@H]3C)))))CC6CCC4)))))))))))s5
|
[C][O][C][C][=N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C@][Branch1][C][F][C][C@H1][Ring1][Ring2][C][C][C][Ring1][=N][C][C][C][Ring1][Ring2][S][Ring2][Ring1][Branch2]
|
[C@H]17CCN5CC12CCC2.c1%10ncc8s1.[C@@]19(F)C[C@H]1C.C48=O.C59=O.CO6.C6%10.N47
|
Cc1cccc(OCC(=O)N2CC[C@H](NC(=O)c3nc(Cl)cc(N)c3Cl)C2)c1
|
CcccccOCC=O)NCC[C@H]NC=O)cncCl)ccN)c6Cl)))))))))C5))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Branch1][O][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=N][C][Branch1][C][Cl][=C][C][Branch1][C][N][=C][Ring1][Branch2][Cl][C][Ring1][P][=C][Ring2][Ring1][O]
|
c19nc(Cl)cc(N)c1Cl.Cc1cccc7c1.N14CC[C@H]8C1.C6C4=O.C59=O.O67.N58
|
O=C(NC[C@@H]1CCCCS1)[C@H]1CN(C(=O)c2cc(O)ncn2)C2(CCC2)C1
|
O=CNC[C@@H]CCCCS6))))))))[C@H]CNC=O)cccO)ncn6)))))))CCCC4)))C5
|
[O][=C][Branch1][O][N][C][C@@H1][C][C][C][C][S][Ring1][=Branch1][C@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=N][C][=N][Ring1][#Branch1][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][P]
|
[C@H]17CN4C2(CCC2)C1.c16cc(O)ncn1.[C@@H]18CCCCS1.O=C37.C46=O.N35.C58
|
Cc1nc[nH]c1C(=O)N[C@@H]1CCN(C(=O)[C@@H]2CC3(CCCCC3)CO2)C1
|
Ccnc[nH]c5C=O)N[C@@H]CCNC=O)[C@@H]CCCCCCC6)))))CO5))))))C5
|
[C][C][N][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][O][Ring1][#Branch2][C][Ring1][P]
|
[C@@H]17CC2(CCCCC2)CO1.Cc1nc[nH]c18.[C@@H]16CCN5C1.C48=O.C57=O.N46
|
Cc1ncc(CCC(=O)N(C)[C@H]2CCN(C(=O)c3ccc4c(c3)C(=O)NC4)C2)o1
|
CcnccCCC=O)NC)[C@H]CCNC=O)cccccc6)C=O)NC5)))))))))C5)))))))))o5
|
[C][C][=N][C][=C][Branch2][Ring2][O][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Ring1][#Branch1][C][Ring1][P][O][Ring2][Ring1][N]
|
c18ccc2c(c1)C(=O)NC2.Cc1ncc9o1.[C@H]17CCN6C1.C9CC5=O.N57C.C68=O
|
COC(=O)N[C@@H](C(=O)N(C)CC1CCN(C(=O)CCCN(C)C)CC1)C(C)C
|
COC=O)N[C@@H]C=O)NC)CCCCNC=O)CCCNC)C))))))CC6)))))))))CC)C
|
[C][O][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][C][N][Branch1][C][C][C][C][C][Ring1][=C][C][Branch1][C][C][C]
|
[C@H]6(C4=O)C(C)C.C19CCN5CC1.C5(=O)CCC8.C23=O.N47C.N8(C)C.CO2.N36.C79
|
CCC(CC)[C@@H](OC)C(=O)N1CC(F)(F)CC2(CCC2)C1
|
CCCCC))[C@@H]OC))C=O)NCCF)F)CCCCC4)))C6
|
[C][C][C][Branch1][Ring1][C][C][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring1][O]
|
N13CC(F)(F)CC2(CCC2)C1.CCC(CC)[C@@H]4C3=O.O4C
|
CCOC=CC(=O)N[C@@H]1CCC[C@@H]1CNC(=O)C1=C[C@@H]2CCCCC[C@@H]12
|
CCOC=CC=O)N[C@@H]CCC[C@@H]5CNC=O)C=C[C@@H]CCCCC[C@@H]97
|
[C][C][O][C][=C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C@@H1][C][C][C][C][C][C@@H1][Ring1][=Branch2][Ring1][#Branch1]
|
C4(=O)C1=C[C@@H]2CCCCC[C@@H]12.O5C=CC3=O.[C@@H]17CCC[C@@H]18.CC5.N37.C68.N46
|
CC1=NNC(=O)[C@H]1CC(=O)N[C@@H](CNC(=O)c1cncc2ccsc12)CC(C)C
|
CC=NNC=O)[C@H]5CC=O)N[C@@H]CNC=O)ccnccccsc95))))))))))))CCC)C
|
[C][C][=N][N][C][=Branch1][C][=O][C@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][C][=C][S][C][Ring1][=Branch2][=Ring1][Branch1][C][C][Branch1][C][C][C]
|
c17cncc2ccsc12.CC1=NNC(=O)[C@H]18.[C@H]5(C6)CC(C)C.C8C3=O.C47=O.N35.N46
|
Cc1cc(CC(=O)N2[C@@H]3CC[C@@H](C3)[C@H]2CNC(=O)c2cc(C)c(C)o2)c(C)s1
|
CcccCC=O)N[C@@H]CC[C@@H]C5)[C@H]6CNC=O)cccC)cC)o5))))))))))))))))cC)s5
|
[C][C][=C][C][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][Branch1][C@H1][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][O][Ring1][#Branch1][=C][Branch1][C][C][S][Ring2][Ring1][O]
|
N14[C@@H]2CC[C@@H](C2)[C@H]18.Cc1cc9c(C)s1.c17cc(C)c(C)o1.C9C4=O.C57=O.C68.N56
|
C=C(C)CNc1nc(N2CCN3C[C@@H](C)C[C@@H]3C2)nc2c1ncn2C(C)C
|
C=CC)CNcncNCCNC[C@@H]C)C[C@@H]5C9)))))))))ncc6ncn5CC)C
|
[C][=C][Branch1][C][C][C][N][C][=N][C][Branch1][P][N][C][C][N][C][C@@H1][Branch1][C][C][C][C@@H1][Ring1][=Branch1][C][Ring1][#Branch2][=N][C][=C][Ring1][S][N][=C][N][Ring1][Branch1][C][Branch1][C][C][C]
|
c15nc6nc2c1ncn27.N16CCN2C[C@@H](C)C[C@@H]2C1.C=C(C)C4.C7(C)C.N45
|
C#CCNC(=O)CC(=O)N1C[C@@H](N(C)C(=O)CC2CC(C)C2)C2(CC2)C1
|
C#CCNC=O)CC=O)NC[C@@H]NC)C=O)CCCCC)C4)))))))CCC3))C5
|
[C][#C][C][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][Branch1][C][C][C][Ring1][Branch1][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][P]
|
N14C[C@@H]7C2(CC2)C1.C3(=O)CC4=O.C18CC(C)C1.C5(=O)C8.C#CC6.N57C.N36
|
CCCc1ncc(C(=O)N(C)C2CN(C(=O)c3c[nH]c4cccnc34)C2)s1
|
CCCcnccC=O)NC)CCNC=O)cc[nH]ccccnc96))))))))))C4))))))s5
|
[C][C][C][C][=N][C][=C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][=C][N][=C][Ring1][=Branch2][Ring1][=Branch1][C][Ring1][#C][S][Ring2][Ring1][Branch2]
|
c19c[nH]c2cccnc12.c1%10ncc8s1.C17CN6C1.CCC%10.C58=O.N57C.C69=O
|
CO[C@H](C(=O)N1CC(C2CN(C(=O)C[C@H]3CCCCN3C)C2)C1)C1CCC1
|
CO[C@H]C=O)NCCCCNC=O)C[C@H]CCCCN6C)))))))))C4))))C4)))))CCCC4
|
[C][O][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C@H1][C][C][C][C][N][Ring1][=Branch1][C][C][Ring1][=C][C][Ring2][Ring1][C][C][C][C][C][Ring1][Ring2]
|
N14CC(C2CN5C2)C1.[C@H]17CCCCN1C.[C@H]68C4=O.C5(=O)C7.C18CCC1.CO6
|
O=C(C=CCF)NC[C@H]1C[C@@H]1CNC(=O)c1cc2ccc(F)cc2o1
|
O=CC=CCF))))NC[C@H]C[C@@H]3CNC=O)ccccccF)cc6o9
|
[O][=C][Branch1][Branch1][C][=C][C][F][N][C][C@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][Ring1][#Branch2]
|
c17cc2ccc(F)cc2o1.O=C3C=8.[C@H]19C[C@@H]1%10.C=8CF.C47=O.N35.C59.C6%10.N46
|
CC1(C)[C@H](C(=O)NCCCCc2cnc[nH]2)CCN1C(=O)[C@H]1CNC(=O)C1
|
CCC)[C@H]C=O)NCCCCccnc[nH]5)))))))))))CCN5C=O)[C@H]CNC=O)C5
|
[C][C][Branch1][C][C][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][=C][NH1][Ring1][Branch1][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C@H1][C][N][C][=Branch1][C][=O][C][Ring1][=Branch1]
|
CC1(C)[C@H]6CCN14.[C@H]17CNC(=O)C1.C5CCC8.c18cnc[nH]1.C36=O.C47=O.N35
|
CC[C@@H](CNC(=O)[C@@](C)(F)C(C)(C)F)NC(=O)C12CCCCC(OC)(C1)C2
|
CC[C@@H]CNC=O)[C@@]C)F)CC)C)F))))))NC=O)CCCCCCOC))C7)C7
|
[C][C][C@@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch1][C][F][C][Branch1][C][C][Branch1][C][C][F][N][C][=Branch1][C][=O][C][C][C][C][C][C][Branch1][Ring1][O][C][Branch1][Ring2][C][Ring1][=Branch2][C][Ring1][#Branch2]
|
C3(=O)[C@@](C)(F)C(C)(C)F.C128CCCCC5(C1)C2.CC[C@H]6C7.C48=O.N37.N46.O5C
|
CCc1cnc(CC(=O)N2C[C@H]3C[C@@H](C2)N(C(=O)[C@@H](C)OC)C3)[nH]1
|
CCccncCC=O)NC[C@H]C[C@@H]C6)NC=O)[C@@H]C)OC))))C5)))))))))[nH]5
|
[C][C][C][=C][N][=C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@H1][C][C@@H1][Branch1][Ring2][C][Ring1][=Branch1][N][Branch1][O][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][Ring1][N][NH1][Ring2][Ring1][=Branch1]
|
N14C[C@H]2C[C@@H](C1)N5C2.c17cnc8[nH]1.C5(=O)[C@H]6C.C8C4=O.CC7.O6C
|
CCc1ncc(C(=O)N2CCC(F)(C(=O)N3CCC[C@@H]3C(N)=O)CC2)cn1
|
CCcnccC=O)NCCCF)C=O)NCCC[C@@H]5CN)=O))))))))CC6)))))))cn6
|
[C][C][C][=N][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][P][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][Branch1][C][N][=O][C][C][Ring1][P][C][=N][Ring2][Ring1][=Branch2]
|
N14CCC7(F)CC1.c19ncc8cn1.N15CCC[C@@H]16.C48=O.C57=O.C6(N)=O.CC9
|
CN=c1[nH]cc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)o1
|
CN=c[nH]ccC=O)NCC[C@@H]OCCCcccccc6))))))))))C5))))))o5
|
[C][N][=C][NH1][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=N][O][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#C][O][Ring2][Ring1][=Branch1]
|
CN=c1[nH]cc7o1.N14CC[C@@H]6C1.c18ccccc1.C5CC8.C47=O.O56
|
CCCCC(=O)N1C[C@H](OC)C[C@]1(C)CNC(=O)c1cc2sccc2n1C
|
CCCCC=O)NC[C@H]OC))C[C@]5C)CNC=O)cccsccc5n8C
|
[C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][S][C][=C][C][=Ring1][Branch1][N][Ring1][Branch2][C]
|
c17cc2sccc2n1C.N13C[C@H]5C[C@@]18C.CCCCC3=O.C47=O.O5C.C68.N46
|
C[C@H](C(=O)N1C[C@@H](CNC(=O)Cc2ccc(F)cc2Cl)[C@@H](C)C1)c1ccco1
|
C[C@H]C=O)NC[C@@H]CNC=O)CccccF)cc6Cl)))))))))))[C@@H]C)C5))))))cccco5
|
[C][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Cl][C@@H1][Branch1][C][C][C][Ring2][Ring1][Ring1][C][=C][C][=C][O][Ring1][Branch1]
|
c18ccc(F)cc1Cl.N13C[C@@H]7[C@@H](C)C1.C[C@@H]6C3=O.c16ccco1.C4(=O)C8.C57.N45
|
C#Cc1cccc(C(=O)NC[C@@H]2CO[C@H](CNC(=O)C3(NC(C)C)CC3)C2)c1C
|
C#CcccccC=O)NC[C@@H]CO[C@H]CNC=O)CNCC)C)))CC3))))))C5))))))))c6C
|
[C][#C][C][=C][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C][C@@H1][C][O][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][#Branch1][N][C][Branch1][C][C][C][C][C][Ring1][#Branch1][C][Ring1][S][=C][Ring2][Ring1][#Branch2][C]
|
C#Cc1cccc%12c1C.[C@@H]15CO[C@H]%13C1.C19%11CC1.C4%12=O.C6%11=O.C%10(C)C.N47.C75.C8%13.N68.N9%10
|
Cc1cnc(CN2CCC[C@@H](NC(=O)[C@H](C)NC(N)=O)CC2)s1
|
CccncCNCCC[C@@H]NC=O)[C@H]C)NCN)=O))))))CC7))))))))s5
|
[C][C][=C][N][=C][Branch2][Ring1][N][C][N][C][C][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][Branch1][C][N][=O][C][C][Ring1][S][S][Ring2][Ring1][=Branch1]
|
N15CCC[C@@H]7CC1.Cc1cnc8s1.C3(=O)[C@@H]6C.C4(N)=O.C58.N37.N46
|
CC[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H]2[C@H](NC(=O)CN(C)S(N)(=O)=O)C[C@@H]21
|
CC[C@@H]Ccccccc6)))))))C=O)NCC[C@@H][C@H]NC=O)CNC)SN)=O)=O))))))C[C@@H]47
|
[C][C][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][N][Branch1][C][C][S][Branch1][C][N][=Branch1][C][=O][=O][C][C@@H1][Ring1][=C][Ring1][P]
|
N13CC[C@@H]2[C@H]6C[C@@H]21.CC[C@@H](C7)C3=O.c17ccccc1.N5(C)S(N)(=O)=O.C4(=O)C5.N46
|
C/C(=C\CNC(=O)[C@]12CSC[C@@H]1C2)C(=O)N1C[C@@H](CO)CC[C@H]1C
|
C/C=C\CNC=O)[C@]CSC[C@@H]5C6))))))))))C=O)NC[C@@H]CO))CC[C@H]6C
|
[C][/C][=Branch2][Ring1][C][=C][\C][N][C][=Branch1][C][=O][C@][C][S][C][C@@H1][Ring1][Branch1][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][C][O][C][C][C@H1][Ring1][Branch2][C]
|
N14C[C@@H]8CC[C@H]1C.[C@]126CSC[C@@H]1C2.CC=7C4=O.C=7C5.C36=O.N35.C8O
|
Cc1csc(C(=O)N2CCC(O)(CC(=O)Nc3conc3C)CC2)c1
|
CccscC=O)NCCCO)CC=O)Ncconc5C)))))))))CC6)))))))c5
|
[C][C][=C][S][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][Branch1][#C][C][C][=Branch1][C][=O][N][C][=C][O][N][=C][Ring1][Branch1][C][C][C][Ring1][P][=C][Ring2][Ring1][Branch2]
|
N14CCC8(O)CC1.Cc1csc7c1.c16conc1C.C8C5=O.C47=O.N56
|
CC(=O)[C@@H](C)C[C@@H](C)C(=O)N1C[C@H](O)[C@@H](N(C)C(=O)[C@H]2C[C@@H]2C(C)(C)C)C1
|
CC=O)[C@@H]C)C[C@@H]C)C=O)NC[C@H]O)[C@@H]NC)C=O)[C@H]C[C@@H]3CC)C)C)))))))C5
|
[C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C@@H1][Branch2][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C@@H1][Ring1][Ring1][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][P]
|
CC(=O)[C@@H](C)C[C@@H](C)C3=O.N13C[C@H]5[C@@H](O)C1.[C@H]16C[C@@H]17.C7(C)(C)C.N45C.C46=O
|
CN(C)c1cccnc1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCO1
|
CNC)ccccnc6C=O)NC[C@H]C[C@H]CC[C@@H]C7)N5C=O)[C@H]CCO4
|
[C][N][Branch1][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C][O][Ring1][Ring2]
|
[C@H]19C[C@H]2CC[C@@H](C1)N24.c16cccnc18.[C@H]17CCO1.CN6C.C38=O.C47=O.N35.C59
|
CO[C@H]1CCC[C@H]1C(=O)N1CC(O)(CCNC(=O)CCOC(C)=O)C1
|
CO[C@H]CCC[C@H]5C=O)NCCO)CCNC=O)CCOCC)=O)))))))))C4
|
[C][O][C@H1][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch1][S][C][C][N][C][=Branch1][C][=O][C][C][O][C][Branch1][C][C][=O][C][Ring1][S]
|
[C@H]16CCC[C@H]18.N13CC9(O)C1.C4(=O)CC5.C38=O.C9C7.C2(C)=O.CO6.N47.O25
|
CO[C@@H](C(=O)N1CCN(C(=O)Cc2sccc2C)CC12CCC2)[C@H]1CCCOC1
|
CO[C@@H]C=O)NCCNC=O)Ccsccc5C))))))))CC6CCC4))))))))))[C@H]CCCOC6
|
[C][O][C@@H1][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][C][S][C][=C][C][=Ring1][Branch1][C][C][C][Ring1][#C][C][C][C][Ring1][Ring2][C@H1][C][C][C][O][C][Ring1][=Branch1]
|
N13CCN4CC12CCC2.c16sccc1C.[C@H]17CCCOC1.[C@@H]57C3=O.C4(=O)C6.CO5
|
CC[C@H]1CN(C(=O)c2cc(C)nc(C(F)F)n2)CCN1C(=O)[C@H]1CCCS1(=O)=O
|
CC[C@H]CNC=O)cccC)ncCF)F))n6)))))))CCN6C=O)[C@H]CCCS5=O)=O
|
[C][C][C@H1][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=N][C][Branch1][=Branch1][C][Branch1][C][F][F][=N][Ring1][#Branch2][C][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C@H1][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O]
|
[C@H]17CN3CCN14.c16cc(C)nc8n1.[C@H]15CCCS1(=O)=O.C36=O.C8(F)F.C45=O.CC7
|
C[C@]1(F)CC[C@@H](C(=O)NC2CC(CCNC(=O)[C@H]3C[C@@H](O)C3)C2)CC1
|
C[C@]F)CC[C@@H]C=O)NCCCCCNC=O)[C@H]C[C@@H]O)C4))))))))C4))))))CC6
|
[C][C@][Branch1][C][F][C][C][C@@H1][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][P][C][C][N][C][=Branch1][C][=O][C@H1][C][C@@H1][Branch1][C][O][C][Ring1][Branch1][C][Ring1][=C][C][C][Ring2][Ring1][Branch2]
|
C[C@]1(F)CC[C@@H]8CC1.C17CC%10C1.[C@H]19C[C@@H](O)C1.C48=O.C%10C6.C59=O.N47.N56
|
CC1=C(C(=O)N2CC[C@H](CNC(=O)c3nccc(C)n3)[C@@H](C)C2)CCCO1
|
CC=CC=O)NCC[C@H]CNC=O)cncccC)n6)))))))))[C@@H]C)C6)))))))CCCO6
|
[C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][C@@H1][Branch1][C][C][C][Ring2][Ring1][C][C][C][C][O][Ring2][Ring1][#Branch2]
|
CC1=C(C4=O)CCCO1.N14CC[C@H]8[C@@H](C)C1.c17nccc(C)n1.C57=O.C68.N56
|
CCN(C[C@H](C)NC(=O)[C@H](C)CC(F)(F)F)C(=O)C1CC2(CC(F)C2)C1
|
CCNC[C@H]C)NC=O)[C@H]C)CCF)F)F))))))))C=O)CCCCCF)C4)))C4
|
[C][C][N][Branch2][Ring1][Branch2][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][=Branch1][C][=O][C][C][C][Branch1][=Branch2][C][C][Branch1][C][F][C][Ring1][Branch1][C][Ring1][Branch2]
|
C3(=O)[C@H](C)CC(F)(F)F.C18CC2(C1)CC(F)C2.C6[C@@H]7C.N456.C48=O.CC5.N37
|
Cc1ncc(C(=O)NC[C@@](C)(O)[C@@H]2CCCN(C(=O)C(C)(C)CC(C)C)C2)s1
|
CcnccC=O)NC[C@@]C)O)[C@@H]CCCNC=O)CC)C)CCC)C)))))C6))))))))))s5
|
[C][C][=N][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][C][O][C@@H1][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][C][C][Ring1][#C][S][Ring2][Ring1][O]
|
C4(=O)C(C)(C)CC(C)C.[C@@H]17CCCN4C1.Cc1ncc6s1.C5[C@@]7(C)O.C36=O.N35
|
CCc1nc(C(=O)N(CC)CCNC(=O)[C@@H]2CCCN2C2CC2)co1
|
CCcncC=O)NCC))CCNC=O)[C@@H]CCCN5CCC3))))))))))))))co5
|
[C][C][C][=N][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][C][C][Ring1][Ring1][=C][O][Ring2][Ring1][#Branch1]
|
c1%11nc%10co1.[C@@H]19CCCN18.C3%10=O.N356.C6C7.C49=O.C18CC1.CC%11.C5C.N47
|
Cn1cnc(C(=O)N2CC[C@@H]3C[C@@H](NC(=O)CSCc4cccs4)CC[C@@H]3C2)c1
|
CncncC=O)NCC[C@@H]C[C@@H]NC=O)CSCccccs5))))))))))CC[C@@H]6C%10)))))))))))c5
|
[C][N][C][=N][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][C][C@@H1][Branch1][S][N][C][=Branch1][C][=O][C][S][C][C][=C][C][=C][S][Ring1][Branch1][C][C][C@@H1][Ring1][P][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][N]
|
N15CC[C@@H]2C[C@@H]9CC[C@@H]2C1.Cn1cnc%10c1.c1%11cccs1.C6(=O)C7.C5%10=O.N69.S78.C8%11
|
CCOc1c(F)cccc1C(=O)N[C@H](C)[C@@H]1CCCCN1C(=O)CN(C)CC
|
CCOccF)cccc6C=O)N[C@H]C)[C@@H]CCCCN6C=O)CNC)CC
|
[C][C][O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C]
|
c15c9cccc1F.[C@@H]1%10CCCCN13.C3(=O)C7.C29=O.[C@H]6%10C.N78C.CC4.O45.N26.C8C
|
COC(=O)[C@@H]1C[C@H](O)CCN1[C@H](C(=O)NCc1nnn(C)n1)c1ccc(CO)o1
|
COC=O)[C@@H]C[C@H]O)CCN6[C@H]C=O)NCcnnnC)n5))))))))ccccCO))o5
|
[C][O][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][O][C][C][N][Ring1][#Branch1][C@H1][Branch1][P][C][=Branch1][C][=O][N][C][C][N][=N][N][Branch1][C][C][N][=Ring1][=Branch1][C][=C][C][=C][Branch1][Ring1][C][O][O][Ring1][#Branch1]
|
[C@@H]16C[C@H](O)CCN14.c18nnn(C)n1.c17ccc9o1.[C@H]47C3=O.C26=O.CO2.N35.C58.C9O
|
C/C(=C\C(=O)NC[C@@H](O)CNC(=O)CCSC1CCCC1)c1cccc(F)c1
|
C/C=C\C=O)NC[C@@H]O)CNC=O)CCSCCCCC5))))))))))))))))cccccF)c6
|
[C][/C][=Branch2][Ring1][N][=C][\C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][C][S][C][C][C][C][C][Ring1][Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]
|
CC=7c1cccc(F)c1.C4[C@@H](O)C5.C3(=O)CC6.C18CCCC1.C=7C2=O.N24.N35.S68
|
O=C(C1CCS(=O)(=O)CC1)N1CC2(CCCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1
|
O=CCCCS=O)=O)CC6))))))NCCCCCCNC=O)[C@@H]CCCF)F)C5))))))C7))))))C4
|
[O][=C][Branch1][#C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][Branch2][N][C][C][Branch2][Ring1][=N][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14CC2(CCCCN5C2)C1.C16CCS(=O)(=O)CC1.[C@@H]17CCC(F)(F)C1.O=C46.C57=O
|
N#Cc1ccc2nc(NC(=O)c3csc4c3CCN(Cc3ncco3)C4)[nH]c2c1
|
N#CccccncNC=O)ccscc5CCNCcncco5))))))C6)))))))))))[nH]c5c9
|
[N][#C][C][=C][C][=C][N][=C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][C][N][Branch1][=Branch2][C][C][=N][C][=C][O][Ring1][Branch1][C][Ring1][N][NH1][C][Ring2][Ring1][#Branch1][=C][Ring2][Ring1][O]
|
N#Cc1ccc2nc7[nH]c2c1.c18csc2c1CCN6C2.c19ncco1.C58=O.N57.C69
|
CCNC(=O)CC(=O)N[C@@H]1CCN(C(=O)c2n[nH]cc2C(=O)OC)C[C@H]1O
|
CCNC=O)CC=O)N[C@@H]CCNC=O)cn[nH]cc5C=O)OC)))))))))C[C@H]6O
|
[C][C][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C@@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][=Branch1][C][=O][O][C][C][C@H1][Ring1][P][O]
|
[C@@H]18CCN6C[C@H]1O.C4(=O)CC5=O.c19n[nH]cc1%10.C69=O.C3%10=O.CC7.N47.N58.O3C
|
C[C@@H](NC(=O)c1cnn2c1OCCC2)[C@@H]1CCCN1C(=O)C[C@H]1CCCC12CC2
|
C[C@@H]NC=O)ccnnc5OCCC6)))))))))))[C@@H]CCCN5C=O)C[C@H]CCCC5CC3
|
[C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=N][N][C][=Ring1][Branch1][O][C][C][C][Ring1][=Branch1][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C@H1][C][C][C][C][Ring1][Branch1][C][C][Ring1][Ring1]
|
c16cnn2c1OCCC2.[C@H]18CCCC12CC2.[C@@H]17CCCN14.C4(=O)C8.C[C@@H]57.C36=O.N35
|
CCCn1ccc(C(=O)N2C[C@H](C)CC[C@H]2C(=O)NC[C@H]2CC(CC)=NO2)n1
|
CCCncccC=O)NC[C@H]C)CC[C@H]6C=O)NC[C@H]CCCC))=NO5)))))))))))))))n5
|
[C][C][C][N][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@H1][C][C][Branch1][Ring1][C][C][=N][O][Ring1][#Branch1][=N][Ring2][Ring1][=Branch2]
|
N13C[C@H](C)CC[C@H]16.[C@H]19CC(CC)=NO1.n18ccc7n1.CCC8.C37=O.C46=O.N45.C59
|
Cc1cncc(/C=C/C(=O)N2C[C@H](C)C[C@H](CNC(=O)C[C@@H]3C=CCCC3)C2)c1
|
Cccncc/C=C/C=O)NC[C@H]C)C[C@H]CNC=O)C[C@@H]C=CCCC6))))))))))C6)))))))))c6
|
[C][C][=C][N][=C][C][Branch2][Ring2][Ring2][/C][=C][/C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C@H1][Branch1][S][C][N][C][=Branch1][C][=O][C][C@@H1][C][=C][C][C][C][Ring1][=Branch1][C][Ring2][Ring1][C][=C][Ring2][Ring1][N]
|
Cc1cncc(C=7)c1.N14C[C@@H]8C[C@@H](C)C1.[C@@H]19C=CCCC1.C=7C4=O.C5(=O)C9.C68.N56
|
C#CCN(CC(=O)NCCC(C)(C)C1CC1)C(=O)[C@H](F)C[C@H]1CCOC1
|
C#CCNCC=O)NCCCC)C)CCC3)))))))))C=O)[C@H]F)C[C@H]CCOC5
|
[C][#C][C][N][Branch2][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C@H1][Branch1][C][F][C][C@H1][C][C][O][C][Ring1][Branch1]
|
C6CC7(C)C.C3(=O)[C@H](F)C8.[C@H]18CCOC1.C5C2=O.C#CC4.N345.C17CC1.N26
|
CCCCS[C@H](C)C(=O)NC1CCN(C(=O)c2ccc(CC)cc2N)CC1
|
CCCCS[C@H]C)C=O)NCCCNC=O)ccccCC))cc6N))))))))CC6
|
[C][C][C][C][S][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][C][C][=C][Ring1][Branch2][N][C][C][Ring1][P]
|
c18ccc9cc1N.C17CCN4CC1.[C@@H]6(C)C3=O.CCCC5.C48=O.S56.N37.C9C
|
CS(=O)(=O)c1ccnc(N2CCC(C3CCN(C(=O)C4CCCC4)CC3)CC2)n1
|
CS=O)=O)cccncNCCCCCCNC=O)CCCCC5))))))CC6))))))CC6))))))n6
|
[C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=N][C][Branch2][Ring2][C][N][C][C][C][Branch2][Ring1][=Branch1][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][=N][C][C][Ring2][Ring1][Ring1][=N][Ring2][Ring1][=Branch2]
|
N16CCC(C2CCN5CC2)CC1.CS(=O)(=O)c1ccnc6n1.C17CCCC1.C57=O
|
C[C@H](C(=O)NCc1ccnc(C#N)c1)[C@H]1CCN(C(=O)c2ccc(Cl)cc2)C1
|
C[C@H]C=O)NCcccncC#N))c6)))))))))[C@H]CCNC=O)ccccCl)cc6)))))))C5
|
[C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=N][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C@H1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Ring1][=C]
|
c18ccnc(C#N)c1.c16ccc(Cl)cc1.[C@H]17CCN4C1.C[C@@H]7C3=O.C46=O.N35.C58
|
COc1ccc(C(=O)N[C@@H]2CN(C(=O)C(C)(C)N3CCCC3)CC3(CC3)C2)cc1
|
COccccC=O)N[C@@H]CNC=O)CC)C)NCCCC5)))))))CCCC3))C6))))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][N][C][C][C][C][Ring1][Branch1][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][O]
|
[C@@H]18CN5CC2(CC2)C1.c16ccc9cc1.C5(=O)C7(C)C.N17CCCC1.C49=O.CO6.N48
|
N#Cc1cccc(C(=O)N2CC[C@@H](NC(=O)c3ncc4ccccn34)C2)c1
|
N#CcccccC=O)NCC[C@@H]NC=O)cnccccccn96)))))))))))C5))))))c6
|
[N][#C][C][=C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][C][Ring1][P][=C][Ring2][Ring1][=Branch2]
|
c18ncc2ccccn12.N#Cc1cccc9c1.N15CC[C@@H]7C1.C59=O.C68=O.N67
|
CC(C)N(Cc1ccco1)C(=O)NCc1nc(-c2cccc(Br)c2)no1
|
CCC)NCcccco5))))))C=O)NCcnc-cccccBr)c6))))))no5
|
[C][C][Branch1][C][C][N][Branch1][=Branch2][C][C][=C][C][=C][O][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=N][C][Branch1][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][=N][O][Ring1][N]
|
c1%10cccc(Br)c1.c19nc%10no1.c18ccco1.CC5C.N356.C34=O.C68.N47.C79
|
CC[C@]1(C(=O)NCc2cn[nH]c2)CCCN(C(=O)c2ccc(C#N)n2C)C1
|
CC[C@]C=O)NCccn[nH]c5))))))))CCCNC=O)ccccC#N))n5C)))))))C6
|
[C][C][C@][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][=N][NH1][C][=Ring1][Branch1][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][N][Ring1][#Branch1][C][C][Ring2][Ring1][=Branch2]
|
[C@]178CCCN4C1.c16ccc(C#N)n1C.c19cn[nH]c1.C37=O.C46=O.CC8.N35.C59
|
CCCN(C)CC(=O)N1CCC[C@](F)(CNC(=O)c2c[nH]c3c(F)cccc23)C1
|
CCCNC)CC=O)NCCC[C@]F)CNC=O)cc[nH]ccF)cccc96))))))))))))C6
|
[C][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][F][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][NH1][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][Ring2][Ring1][Branch1]
|
c19c[nH]c2c(F)cccc12.N14CCC[C@@]%10(F)C1.C7C4=O.CCC6.N67C.C59=O.C8%10.N58
|
CC(=O)NCC(=O)NCC(=O)N1C[C@H](NC(=O)c2c(C)[nH][nH]c2=N)C[C@@H]1C
|
CC=O)NCC=O)NCC=O)NC[C@H]NC=O)ccC)[nH][nH]c5=N))))))))C[C@@H]5C
|
[C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][=C][Branch1][C][C][NH1][NH1][C][Ring1][=Branch1][=N][C][C@@H1][Ring1][#C][C]
|
N15C[C@H]9C[C@@H]1C.c1%10c(C)[nH][nH]c1=N.C7C4=O.C8C5=O.CC3=O.C6%10=O.N37.N48.N69
|
Cc1coc(C(=O)NC[C@@H](O)CNC(=O)CS(=O)(=O)Cc2cccs2)c1
|
CccocC=O)NC[C@@H]O)CNC=O)CS=O)=O)Cccccs5)))))))))))))))c5
|
[C][C][=C][O][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][S][Ring1][Branch1][=C][Ring2][Ring1][=Branch2]
|
C4(=O)CS(=O)(=O)C8.Cc1coc7c1.C5[C@@H](O)C6.c18cccs1.C37=O.N35.N46
|
CO[C@@H](C(=O)NC[C@@H]1CN(C(=O)C(C)(C)CC(F)(F)F)CCN1C)C1CCC1
|
CO[C@@H]C=O)NC[C@@H]CNC=O)CC)C)CCF)F)F)))))CCN6C))))))))))CCCC4
|
[C][O][C@@H1][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][N][Ring1][S][C][C][C][C][C][Ring1][Ring2]
|
C3(=O)C(C)(C)CC(F)(F)F.[C@@H]16CN3CCN1C.[C@@H]47C2=O.C17CCC1.CO4.N25.C56
|
CC(C)[C@H](CO)N(C)C(=O)NC[C@H]1CN2CCC1CC2
|
CCC)[C@H]CO))NC)C=O)NC[C@H]CNCCC6CC6
|
[C][C][Branch1][C][C][C@H1][Branch1][Ring1][C][O][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][N][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1]
|
[C@H]17CN2CCC1CC2.CC(C)[C@@H]5CO.N35C.C34=O.N46.C67
|
CC/C=C/CC(=O)N1CC(CCO)(NC(=O)C[C@H](OCC)C(C)C)C1
|
CC/C=C/CC=O)NCCCCO)))NC=O)C[C@H]OCC)))CC)C))))))C4
|
[C][C][/C][=C][/C][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][C][O][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][Branch1][Ring2][O][C][C][C][Branch1][C][C][C][C][Ring2][Ring1][C]
|
C3(=O)C[C@H]4C(C)C.N12CC68C1.C=7CC2=O.CCC=7.C8CO.N36.O45.C5C
|
Cc1cc(C(=O)NCCN(C[C@@H](C)O)C(=O)c2cscc2F)no1
|
CcccC=O)NCCNC[C@@H]C)O)))C=O)ccscc5F))))))))))))no5
|
[C][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C@@H1][Branch1][C][C][O][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][F][=N][O][Ring2][Ring1][#Branch1]
|
Cc1cc8no1.c19cscc1F.C7[C@@H](C)O.C38=O.C5C6.N467.C49=O.N35
|
Cc1cccc([C@H](C)NC(=O)[C@@H]2C[C@H](O)CN2c2ncnc3cc(Br)sc23)c1
|
Cccccc[C@H]C)NC=O)[C@@H]C[C@H]O)CN5cncncccBr)sc95)))))))))))))))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][Ring2][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=N][C][=N][C][C][=C][Branch1][C][Br][S][C][Ring1][#Branch2][=Ring1][=Branch1][=C][Ring2][Ring1][O]
|
c16ncnc2cc(Br)sc12.Cc1cccc8c1.[C@@H]17C[C@H](O)CN16.[C@@H]58C.C47=O.N45
|
CS[C@H](C)C(=O)NC[C@@H]1C[C@@H](O)CN1C(=O)[C@H](O)COCc1ccccc1
|
CS[C@H]C)C=O)NC[C@@H]C[C@@H]O)CN5C=O)[C@H]O)COCcccccc6
|
[C][S][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
[C@@H]18C[C@@H](O)CN13.C3(=O)[C@H](O)C4.c19ccccc1.[C@@H]7(C)C2=O.CS7.N26.C68.O45.C59
|
Cc1nc(CO)oc1C(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1CCC(C)(C)OC1
|
CcncCO))oc5C=O)NCC[C@H][C@@H]5CCCN6C=O)[C@@H]CCCC)C)OC6
|
[C][C][N][=C][Branch1][Ring1][C][O][O][C][=Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@H1][C@@H1][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][Branch2]
|
N13CC[C@H]2[C@@H]1CCCN24.[C@@H]16CCC(C)(C)OC1.Cc1nc7oc15.C35=O.C46=O.C7O
|
CCc1ccc(Cl)c(C(=O)NC[C@@](C)(NC(=O)[C@@H](O)C2CCC2)C2CCC2)c1
|
CCccccCl)cC=O)NC[C@@]C)NC=O)[C@@H]O)CCCC4)))))))CCCC4))))))))c6
|
[C][C][C][=C][C][=C][Branch1][C][Cl][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][S][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][C][Ring1][Ring2][C][C][C][C][Ring1][Ring2][=C][Ring2][Ring1][#Branch2]
|
c1%10ccc(Cl)c7c1.C5[C@@]68C.C4(=O)[C@H]9O.C19CCC1.C18CCC1.C37=O.CC%10.N35.N46
|
C=CCCCCCC(=O)N1CCC(CNC(=O)c2ccc(=O)n(C)c2)CC1
|
C=CCCCCCC=O)NCCCCNC=O)cccc=O)nC)c6)))))))))CC6
|
[C][=C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][=Ring1][Branch2][C][C][Ring2][Ring1][C]
|
C=CCCCCCC3=O.c16ccc(=O)n(C)c1.N13CCC7CC1.C46=O.C57.N45
|
COc1ccc([C@H](C)N(C)C(=O)c2ncc(Cl)cc2C)cc1
|
COcccc[C@H]C)NC)C=O)cnccCl)cc6C))))))))))cc6
|
[C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C@H1][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][=C][Ring2][Ring1][Ring2]
|
c16ncc(Cl)cc1C.c14ccc7cc1.[C@@H]57C.N35C.C36=O.CO4
|
CN(Cc1cncs1)C(=O)[C@@H]1COC2(C1)CN(C(=O)[C@]1(C#N)CC1(C)C)C2
|
CNCccncs5))))))C=O)[C@@H]COCC5)CNC=O)[C@]C#N))CC3C)C)))))C4
|
[C][N][Branch1][=Branch2][C][C][=C][N][=C][S][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@][Branch1][Ring1][C][#N][C][C][Ring1][Branch1][Branch1][C][C][C][C][Ring1][=C]
|
[C@@H]16COC2(C1)CN4C2.[C@@]17(C#N)CC1(C)C.c18cncs1.CN35.C36=O.C47=O.C58
|
CC(C)C#CC(=O)N1CCC[C@H](C(=O)N2CC[C@H](N(C)C)[C@@H](C)C2)CC1
|
CCC)C#CC=O)NCCC[C@H]C=O)NCC[C@H]NC)C))[C@@H]C)C6)))))))CC7
|
[C][C][Branch1][C][C][C][#C][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@@H1][Branch1][C][C][C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring1]
|
N13CCC[C@H]6CC1.N14CC[C@H]5[C@@H](C)C1.CC(C)C#CC3=O.C46=O.N5(C)C
|
CC[C@](C)(COC)C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)cc2Cl)C1
|
CC[C@]C)COC)))C=O)NCC[C@@H]CNC=O)ccccO)cc6Cl))))))))))C5
|
[C][C][C@][Branch1][C][C][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][Cl][C][Ring1][P]
|
CC[C@](C)(C5)C3=O.c17ccc(O)cc1Cl.N13CC[C@@H]8C1.C47=O.O5C.C68.N46
|
CCC[C@H](O)C(=O)NCc1ccc(CN(C)C(=O)C2=C(CC)OCCC2)cc1
|
CCC[C@H]O)C=O)NCccccCNC)C=O)C=CCC))OCCC6)))))))))cc6
|
[C][C][C][C@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][Branch1][Ring1][C][C][O][C][C][C][Ring1][Branch2][C][=C][Ring2][Ring1][Ring1]
|
C4(=O)C1=C(CC)OCCC1.CCC[C@H](O)C3=O.c17ccc8cc1.N46C.N35.C57.C68
|
CCc1ccc(OCC(=O)N[C@@H]2[C@H]3CCN(C(=O)c4conc4CC)[C@H]32)cc1
|
CCccccOCC=O)N[C@@H][C@H]CCNC=O)cconc5CC))))))))[C@H]56))))))))))cc6
|
[C][C][C][=C][C][=C][Branch2][Ring1][P][O][C][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][O][N][=C][Ring1][Branch1][C][C][C@H1][Ring1][=C][Ring1][#C][C][=C][Ring2][Ring1][#Branch2]
|
c1%12ccc8cc1.[C@@H]19[C@H]2CCN6[C@@H]12.c1%10conc1%11.C7C5=O.C6%10=O.CC%12.O78.N59.C%11C
|
Cc1cc(CC(=O)N2CC(C)(C)C[C@@H]2C(=O)N2CC[C@@H](C(C)(C)C)C2)no1
|
CcccCC=O)NCCC)C)C[C@@H]5C=O)NCC[C@@H]CC)C)C))C5)))))))))))))no5
|
[C][C][=C][C][Branch2][Ring2][Branch2][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][=Branch2][=N][O][Ring2][Ring1][#Branch2]
|
N13CC(C)(C)C[C@@H]15.Cc1cc6no1.N14CC[C@@H]7C1.C6C3=O.C7(C)(C)C.C45=O
|
CC1(C)C[C@H](CC(=O)NCCCc2cn(CC[C@@H]3CCCC3(F)F)nn2)C(=O)O1
|
CCC)C[C@H]CC=O)NCCCccnCC[C@@H]CCCC5F)F))))))))nn5)))))))))))C=O)O5
|
[C][C][Branch1][C][C][C][C@H1][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][C][=C][N][Branch1][=C][C][C][C@@H1][C][C][C][C][Ring1][Branch1][Branch1][C][F][F][N][=N][Ring1][=C][C][=Branch1][C][=O][O][Ring2][Ring1][N]
|
CC1(C)C[C@H]8C(=O)O1.[C@@H]19CCCC1(F)F.c17cn6nn1.C8C4=O.C5CC7.C6C9.N45
|
COCC[C@@H]1CCCCN1C(=O)Cc1cc(-c2ccc3oncc3c2)ccn1
|
COCC[C@@H]CCCCN6C=O)Cccc-cccconcc5c9)))))))))ccn6
|
[C][O][C][C][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][Branch1][=C][C][=C][C][=C][O][N][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][C][=N][Ring1][#C]
|
c18ccc2oncc2c1.[C@@H]16CCCCN14.c17cc8ccn1.C4(=O)C7.C5C6.CO5
|
CO[C@H](C)CCC(=O)N[C@@H](C)CNC(=O)CCc1nc(C2CC2)no1
|
CO[C@H]C)CCC=O)N[C@@H]C)CNC=O)CCcncCCC3)))no5
|
[C][O][C@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][C][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][O][Ring1][Branch2]
|
[C@@H]5(C)CCC3=O.c18nc9no1.C4(=O)CC8.[C@H]6(C)C7.C19CC1.CO5.N36.N47
|
CC[C@@H]1CCCN1C(=O)C(=O)N1CC=C[C@@H](NC(=O)c2conc2C2CC2)C1
|
CC[C@@H]CCCN5C=O)C=O)NCC=C[C@@H]NC=O)cconc5CCC3))))))))))C6
|
[C][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][=C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][O][N][=C][Ring1][Branch1][C][C][C][Ring1][Ring1][C][Ring1][P]
|
N14CC=C[C@@H]6C1.[C@@H]18CCCN13.c17conc19.C3(=O)C4=O.C57=O.C19CC1.CC8.N56
|
CN(CCC1CCN(C(=O)c2nn[nH]c2Cl)CC1)C(=O)[C@H](O)Cc1ccccc1
|
CNCCCCCNC=O)cnn[nH]c5Cl)))))))CC6))))))))C=O)[C@H]O)Ccccccc6
|
[C][N][Branch2][Ring1][=Branch2][C][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][=N][NH1][C][=Ring1][Branch1][Cl][C][C][Ring1][=C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
C17CCN3CC1.c16nn[nH]c1Cl.C4(=O)[C@H](O)C8.c18ccccc1.CN45.C5C7.C36=O
|
CC[C@](C)(C(N)=O)C(=O)N(C)CCOCCN(C)C(=O)c1cnn(C(C)C)c1C
|
CC[C@]C)CN)=O))C=O)NC)CCOCCNC)C=O)ccnnCC)C))c5C
|
[C][C][C@][Branch1][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][O][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][C][C][=Ring1][Branch2][C]
|
CC[C@@](C)(C2=O)C(N)=O.c18cnn9c1C.N26C.C6C4.C5C7.N37C.C38=O.C9(C)C.O45
|
CCn1nnnc1CNC(=O)[C@@H]1CCOCCN1C(=O)c1ccc(O)c(C)c1
|
CCnnnnc5CNC=O)[C@@H]CCOCCN7C=O)ccccO)cC)c6
|
[C][C][N][N][=N][N][=C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][Branch2]
|
[C@@H]15CCOCCN13.c16ccc(O)c(C)c1.n17nnnc18.C25=O.C36=O.CC7.C48.N24
|
CCc1nc([C@@H](C(=O)NC(C)(C)C)N2CC(C)(C)[C@@H]2c2cccs2)cs1
|
CCcnc[C@@H]C=O)NCC)C)C))))NCCC)C)[C@@H]4ccccs5))))))))))cs5
|
[C][C][C][=N][C][Branch2][Ring2][Ring2][C@@H1][Branch1][=C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][N][C][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][=Branch1][C][=C][C][=C][S][Ring1][Branch1][=C][S][Ring2][Ring1][Branch2]
|
N14CC(C)(C)[C@@H]18.c16nc7cs1.[C@H]47C3=O.c18cccs1.C5(C)(C)C.CC6.N35
|
CS[C@@H](C)C(=O)N(C)CCNC(=O)c1ccccc1[C@@H]1CC1(F)F
|
CS[C@@H]C)C=O)NC)CCNC=O)cccccc6[C@@H]CC3F)F
|
[C][S][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F]
|
c17ccccc18.[C@H]6(C)C2=O.[C@@H]18CC1(F)F.N24C.C4C5.C37=O.CS6.N35
|
CCC1(C(=O)N2CC(F)(F)C[C@H]2C(=O)N[C@@H](CO)Cc2ccc(Cl)cc2)COC1
|
CCCC=O)NCCF)F)C[C@H]5C=O)N[C@@H]CO))CccccCl)cc6))))))))))))))))COC4
|
[C][C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][C][Branch1][C][F][Branch1][C][F][C][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][O][C][Ring2][Ring1][O]
|
N13CC(F)(F)C[C@H]16.c19ccc(Cl)cc1.C178COC1.[C@@H]5(C9)CO.C37=O.C46=O.CC8.N45
|
O=C(C=Cc1cscn1)N[C@@]12COCC[C@@H]1CN(C(=O)C1=CCCOCC1)C2
|
O=CC=Cccscn5)))))))N[C@@]COCC[C@@H]6CNC=O)C=CCCOCC7))))))))C9
|
[O][=C][Branch1][#Branch2][C][=C][C][=C][S][C][=N][Ring1][Branch1][N][C@@][C][O][C][C][C@@H1][Ring1][=Branch1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][O][C][C][Ring1][#Branch1][C][Ring2][Ring1][C]
|
[C@@]125COCC[C@@H]1CN4C2.C4(=O)C1=CCCOCC1.C=6c1cscn1.O=C3C=6.N35
|
Cc1nc(C)c(-c2csc(NC(=O)[C@]3(F)CCS(=O)(=O)C3)n2)s1
|
CcncC)c-ccscNC=O)[C@]F)CCS=O)=O)C5)))))))n5)))))s5
|
[C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][S][C][=C][S][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@][Branch1][C][F][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][Branch2][=N][Ring1][S][S][Ring2][Ring1][=Branch1]
|
[C@@]16(F)CCS(=O)(=O)C1.Cc1nc(C)c7s1.c17csc5n1.C46=O.N45
|
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