SMILES
stringlengths 14
128
| Deep SMILES
stringlengths 13
127
| SELFIES
stringlengths 53
379
| SAFE
stringlengths 20
153
|
|---|---|---|---|
Cc1ccc(CN2CC(O)(CNC(=O)CO)C2)cc1F
|
CccccCNCCO)CNC=O)CO)))))C4)))))cc6F
|
[C][C][=C][C][=C][Branch2][Ring1][Branch1][C][N][C][C][Branch1][C][O][Branch1][=Branch2][C][N][C][=Branch1][C][=O][C][O][C][Ring1][O][C][=C][Ring2][Ring1][C][F]
|
Cc1ccc7cc1F.N14CC6(O)C1.C3(=O)CO.C47.C56.N35
|
CCC[C@H](C#N)C(=O)N1CCOCC[C@H]1C(=O)NC1CCN(C)CC1
|
CCC[C@H]C#N))C=O)NCCOCC[C@H]7C=O)NCCCNC)CC6
|
[C][C][C][C@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][N][C][C][O][C][C][C@H1][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1]
|
CCC[C@H](C#N)C2=O.N12CCOCC[C@H]15.C14CCN(C)CC1.C35=O.N34
|
COC(=O)c1cscc1CC(=O)N1C[C@@H](C)[C@H](NC(=O)[C@@]2(C)CCN(C)C2=O)C1
|
COC=O)ccscc5CC=O)NC[C@@H]C)[C@H]NC=O)[C@@]C)CCNC)C5=O))))))))C5
|
[C][O][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][N][Branch1][C][C][C][Ring1][#Branch1][=O][C][Ring1][P]
|
[C@]17(C)CCN(C)C1=O.N14C[C@@H]6[C@H](C)C1.c18cscc19.C9C4=O.C38=O.C57=O.CO3.N56
|
Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccc(O)cc23)cc1
|
CccccC=O)N[C@H]CO))Ccc[nH]ccccO)cc96)))))))))))))cc6
|
[C][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][C][=C][NH1][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=C][Ring2][Ring1][#Branch1]
|
c17c[nH]c2ccc(O)cc12.Cc1ccc6cc1.[C@H]5(C7)CO.C46=O.N45
|
Cc1cc(Cl)ncc1CC(=O)N1C[C@H](NC(=O)c2c(C)csc2Cl)C[C@H]1C
|
CcccCl)ncc6CC=O)NC[C@H]NC=O)ccC)csc5Cl))))))))C[C@H]5C
|
[C][C][=C][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=C][S][C][=Ring1][=Branch1][Cl][C][C@H1][Ring1][#C][C]
|
Cc1cc(Cl)ncc17.N13C[C@H]5C[C@H]1C.c16c(C)csc1Cl.C7C3=O.C46=O.N45
|
CC[C@@H](CC(=O)N1C[C@@H](C)C[C@H](NC(=O)c2csc(Cl)n2)C1)C(F)F
|
CC[C@@H]CC=O)NC[C@@H]C)C[C@H]NC=O)ccscCl)n5)))))))C6))))))))CF)F
|
[C][C][C@@H1][Branch2][Ring2][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Cl][=N][Ring1][=Branch1][C][Ring1][S][C][Branch1][C][F][F]
|
CC[C@@H](CC3=O)C(F)F.N13C[C@@H]5C[C@H](C)C1.c16csc(Cl)n1.C46=O.N45
|
CC(C)N(CCNC(=O)[C@@H]1SCCc2ccccc21)C(=O)c1cc(C(N)=O)[nH]n1
|
CCC)NCCNC=O)[C@@H]SCCcccccc6%10))))))))))))))C=O)cccCN)=O))[nH]n5
|
[C][C][Branch1][C][C][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][S][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][NH1][N][=Ring1][Branch2]
|
C3(=O)[C@@H]1SCCc2ccccc21.c18cc9[nH]n1.CC5C.N456.C6C7.C48=O.C9(N)=O.N37
|
COCC1(CNC(=O)CN(C)C2CCC2)CCN(C(=O)C(F)=C(C)C)CC1
|
COCCCNC=O)CNC)CCCC4)))))))))CCNC=O)CF)=CC)C))))CC6
|
[C][O][C][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][C][C][Ring1][Ring2][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][Branch1][C][F][=C][Branch1][C][C][C][C][C][Ring2][Ring1][Branch2]
|
C1%10%11CCN4CC1.C4(=O)C=9F.C3(=O)C7.C18CCC1.N78C.C=9(C)C.CO5.C5%10.C6%11.N36
|
C[C@@H]1CCC[C@@H](CNC(=O)c2c(CNC(=O)CCCC(=O)C3CC3)cnn2C)O1
|
C[C@@H]CCC[C@@H]CNC=O)ccCNC=O)CCCC=O)CCC3))))))))))cnn5C)))))))))O6
|
[C][C@@H1][C][C][C][C@@H1][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][C][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][=N][N][Ring1][P][C][O][Ring2][Ring1][N]
|
C5(=O)CCCC9=O.C[C@@H]1CCC[C@@H]%10O1.c18c%11cnn1C.C48=O.C19CC1.C6%10.N46.C7%11.N57
|
C#CCNC(=O)CC(=O)NC[C@@H]1C[C@@H]1CNC(=O)c1[nH]nc2ncc(Br)cc12
|
C#CCNC=O)CC=O)NC[C@@H]C[C@@H]3CNC=O)c[nH]ncnccBr)cc96
|
[C][#C][C][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C@@H1][C][C@@H1][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][NH1][N][=C][N][=C][C][Branch1][C][Br][=C][C][=Ring1][#Branch2][Ring1][#Branch1]
|
c19[nH]nc2ncc(Br)cc12.C3(=O)CC4=O.[C@@H]1%10C[C@@H]1%11.C#CC6.C59=O.N36.N47.C7%10.C8%11.N58
|
C[C@@H]1C[C@H](NC(=O)c2cnc(-c3cnn(C)c3)s2)CN1C(=O)c1csc(Cl)n1
|
C[C@@H]C[C@H]NC=O)ccnc-ccnnC)c5)))))s5)))))))CN5C=O)ccscCl)n5
|
[C][C@@H1][C][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][S][Ring1][O][C][N][Ring2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Cl][=N][Ring1][=Branch1]
|
C[C@@H]1C[C@H]6CN15.c17cnc9s1.c19cnn(C)c1.c18csc(Cl)n1.C47=O.C58=O.N46
|
C=CCCCCC(=O)N1Cc2ccccc2[C@@H](NC(=O)[C@]2(C)CCC23CCC3)C1
|
C=CCCCCC=O)NCcccccc6[C@@H]NC=O)[C@]C)CCC4CCC4)))))))))C%10
|
[C][=C][C][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][Ring1][Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Branch1]
|
N14Cc2ccccc2[C@@H](N5)C1.C=CCCCCC4=O.[C@@]16(C)CCC12CCC2.C56=O
|
CN1CCC(CC(=O)N2C[C@@H](NC(=O)C(C)(C)C(N)=O)C[C@]23CCOC3)CC1
|
CNCCCCC=O)NC[C@@H]NC=O)CC)C)CN)=O)))))C[C@]5CCOC5)))))))))))CC6
|
[C][N][C][C][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][N][=O][C][C@][Ring1][=C][C][C][O][C][Ring1][Branch1][C][C][Ring2][Ring1][O]
|
N14C[C@@H]6C[C@]12CCOC2.C5(=O)C(C)(C)C(N)=O.CN1CCC7CC1.C7C4=O.N56
|
COC(C)(C)CCC(=O)N[C@@H]1CCC[C@H]1CNC(=O)C1(S(C)(=O)=O)CCC1
|
COCC)C)CCC=O)N[C@@H]CCC[C@H]5CNC=O)CSC)=O)=O))CCC4
|
[C][O][C][Branch1][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][C][Ring1][Branch2]
|
C4(C)(C)CCC2=O.C17(S(C)(=O)=O)CCC1.[C@@H]16CCC[C@H]18.C37=O.CO4.N26.C58.N35
|
CO[C@@H]1C[C@@H](C(=O)N[C@H](CC(F)(F)F)C(=O)O)N(C(=O)OCc2ccccc2)C1
|
CO[C@@H]C[C@@H]C=O)N[C@H]CCF)F)F)))C=O)O)))))NC=O)OCcccccc6)))))))))C5
|
[C][O][C@@H1][C][C@@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=Branch1][C][=O][O][N][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][O]
|
[C@@H]8(CC(F)(F)F)C(=O)O.[C@@H]17C[C@@H]9N5C1.c1%10ccccc1.C49=O.C35=O.CO7.N48.O36.C6%10
|
O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@@H]2CF)CC1
|
O=CCOcccccc6[N+]=O)[O-]))))))))))N[C@H]CC[C@H]NC=O)[C@@H]C[C@@H]3CF)))))))CC6
|
[O][=C][Branch1][S][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1][N][C@H1][C][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Ring1][Ring1][C][F][C][C][Ring1][=C]
|
c16ccccc1[N+](=O)[O-].[C@H]17CC[C@H]8CC1.O=C3C5.[C@@H]19C[C@@H]1%10.C49=O.O56.N37.N48.C%10F
|
CC[C@@H](SC)C(=O)NC[C@@]1(F)CC[C@@H](NC(=O)c2cccc(C#CCO)c2)C1
|
CC[C@@H]SC))C=O)NC[C@@]F)CC[C@@H]NC=O)cccccC#CCO))))c6))))))))C5
|
[C][C][C@@H1][Branch1][Ring1][S][C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][F][C][C][C@@H1][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch1][C][#C][C][O][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring1]
|
c18cccc(C#CCO)c1.[C@]19(F)CC[C@@H]7C1.CC[C@@H]6C3=O.C48=O.S6C.N35.C59.N47
|
CN(CC1CCN(S(=O)(=O)c2cnn(C)c2)CC1)C(=O)[C@H](CO)c1ccccc1
|
CNCCCCNS=O)=O)ccnnC)c5))))))CC6)))))))C=O)[C@H]CO))cccccc6
|
[C][N][Branch2][Ring1][=C][C][C][C][C][N][Branch2][Ring1][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][Ring1][#C][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
|
S5(=O)(=O)c1cnn(C)c1.C16CCN5CC1.C3(=O)[C@@H]7CO.c17ccccc1.CN34.C46
|
Cc1cc(C(=O)N[C@H]2CCCC[C@@H]2CNC(=O)c2c[nH]c3ccccc23)c(C)o1
|
CcccC=O)N[C@H]CCCC[C@@H]6CNC=O)cc[nH]cccccc96))))))))))))))))))))cC)o5
|
[C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][=C][Branch1][C][C][O][Ring2][Ring1][N]
|
c19c[nH]c2ccccc12.Cc1cc8c(C)o1.[C@H]17CCCC[C@@H]1%10.C48=O.C59=O.N47.C6%10.N56
|
CC(=O)N1CCC[C@@]1(C)C(=O)N1CC([C@H](C)NC(=O)CCc2cnco2)C1
|
CC=O)NCCC[C@@]5C)C=O)NCC[C@H]C)NC=O)CCccnco5))))))))))C4
|
[C][C][=Branch1][C][=O][N][C][C][C][C@@][Ring1][Branch1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][C][C][=C][N][=C][O][Ring1][Branch1][C][Ring1][S]
|
N13CCC[C@]17C.N14CC9C1.C5(=O)CC8.c18cnco1.CC3=O.C47=O.[C@@H]69C.N56
|
CCC(CC)CCC(=O)N(C)CCN(C(=O)c1ccc2c(c1)CCCS2)C(C)C
|
CCCCC))CCC=O)NC)CCNC=O)cccccc6)CCCS6))))))))))CC)C
|
[C][C][C][Branch1][Ring1][C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][S][Ring1][#Branch1][C][Branch1][C][C][C]
|
c18ccc2c(c1)CCCS2.CCC(CC)CCC3=O.N35C.C5C6.N467.C48=O.C7(C)C
|
Cn1cnnc1CNC(=O)[C@H]1c2c[nH]nc2CN1C(=O)c1ccc2c(c1)CC2
|
Cncnnc5CNC=O)[C@H]cc[nH]nc5CN8C=O)cccccc6)CC4
|
[C][N][C][=N][N][=C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][C][=C][NH1][N][=C][Ring1][Branch1][C][N][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Ring1][Branch1]
|
C3(=O)[C@H]1c2c[nH]nc2CN14.c16ccc2c(c1)CC2.Cn1cnnc17.C46=O.C57.N35
|
O=C(CCCc1ccccc1)NC1CC(NC(=O)c2ccc(C(F)F)nc2)C1
|
O=CCCCcccccc6)))))))))NCCCNC=O)ccccCF)F))nc6))))))))C4
|
[O][=C][Branch1][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][F][F][N][=C][Ring1][=Branch2][C][Ring1][S]
|
c17ccc8nc1.O=C3CCC9.c19ccccc1.C15CC6C1.C47=O.C8(F)F.N35.N46
|
CCN(CC)CC[C@H](C)NC(=O)[C@@H]1CC12CC(NC(=O)[C@H]1CCC[C@@H]1O)C2
|
CCNCC))CC[C@H]C)NC=O)[C@@H]CC3CCNC=O)[C@H]CCC[C@@H]5O))))))))C4
|
[C][C][N][Branch1][Ring1][C][C][C][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][Ring1][Ring1][C][C][Branch1][=C][N][C][=Branch1][C][=O][C@H1][C][C][C][C@@H1][Ring1][Branch1][O][C][Ring1][=N]
|
[C@@H]1%10CC12CC9C2.[C@H]1%11CCC[C@@H]1O.C7C[C@@H]8C.N567.C3%10=O.C4%11=O.CC5.C6C.N38.N49
|
CN(C(=O)[C@@H](NC(=O)C1=CCCCCC1)[C@H]1CCCO1)[C@H]1CC[C@H]2C[C@H]21
|
CNC=O)[C@@H]NC=O)C=CCCCCC7)))))))))[C@H]CCCO5)))))))[C@H]CC[C@H]C[C@H]36
|
[C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][C][C][C][C][C][Ring1][#Branch1][C@H1][C][C][C][O][Ring1][Branch1][C@H1][C][C][C@H1][C][C@H1][Ring1][Ring1][Ring1][=Branch1]
|
C4(=O)C1=CCCCCC1.[C@H]16CC[C@H]2C[C@H]21.C3(=O)[C@@H]57.[C@H]17CCCO1.CN36.N45
|
CCOCCCNC(=O)[C@@H](C#N)C(=O)CN1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C1
|
CCOCCCNC=O)[C@@H]C#N))C=O)CNC=O)[C@@H][C@H]C5=O))[C@H]C=C[C@H]6C5
|
[C][C][O][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][Ring1][C][#N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][C@H1][Branch1][Branch1][C][Ring1][=Branch1][=O][C@H1][C][=C][C@H1][Ring1][Branch2][C][Ring1][Branch1]
|
N17C(=O)[C@@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C1.C3(=O)[C@@H](C#N)C(=O)C7.C5CC6.CC4.O45.N36
|
C[C@H](C(=O)NCC(C)(C)C#N)[C@@H](C)NC(=O)c1c(C#N)ncn1C
|
C[C@H]C=O)NCCC)C)C#N))))))[C@@H]C)NC=O)ccC#N))ncn5C
|
[C][C@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][#N][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][Branch1][Ring1][C][#N][N][=C][N][Ring1][#Branch1][C]
|
c16c(C#N)ncn1C.C[C@H](C2=O)[C@H]5C.C4C(C)(C)C#N.C36=O.N24.N35
|
CC[C@@H](CNC(=O)c1cc(C2(O)COC2)on1)NC(=O)[C@]1(C)CCNC(=O)C1
|
CC[C@@H]CNC=O)cccCO)COC4))))on5))))))))NC=O)[C@]C)CCNC=O)C6
|
[C][C][C@@H1][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][#Branch2][C][Branch1][C][O][C][O][C][Ring1][Branch1][O][N][=Ring1][#Branch2][N][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][Ring1][Branch2]
|
[C@@]18(C)CCNC(=O)C1.c17cc9on1.CC[C@H]5C6.C19(O)COC1.C37=O.C48=O.N36.N45
|
Cn1ncc(Cl)c1NC(=O)[C@@H]1C[C@@H]2C[C@H]2N1C(=O)c1ccc(-n2cncn2)cc1
|
CnnccCl)c5NC=O)[C@@H]C[C@@H]C[C@H]3N6C=O)cccc-ncncn5)))))cc6
|
[C][N][N][=C][C][Branch1][C][Cl][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][C][C@H1][Ring1][Ring1][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][=N][C][=N][Ring1][Branch1][C][=C][Ring1][O]
|
Cn1ncc(Cl)c15.[C@@H]16C[C@@H]2C[C@H]2N14.c17ccc8cc1.n18cncn1.C36=O.C47=O.N35
|
CC(=CC(=O)NC[C@](C)(O)C(F)(F)F)CNC(=O)c1ccon1
|
CC=CC=O)NC[C@]C)O)CF)F)F)))))))CNC=O)cccon5
|
[C][C][=Branch2][Ring1][#Branch1][=C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F][C][N][C][=Branch1][C][=O][C][C][=C][O][N][=Ring1][Branch1]
|
C4[C@](C)(O)C(F)(F)F.c16ccon1.CC=7C5.C=7C2=O.C36=O.N24.N35
|
CCCC[C@@H](NC(=O)c1nnn(C)c1N)C(=O)N[C@@H](CC)c1noc(C)n1
|
CCCC[C@@H]NC=O)cnnnC)c5N))))))))C=O)N[C@@H]CC))cnocC)n5
|
[C][C][C][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][N][=N][N][Branch1][C][C][C][=Ring1][=Branch1][N][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][C][C][=N][O][C][Branch1][C][C][=N][Ring1][=Branch1]
|
CCCC[C@@H]4C3=O.c16nnn(C)c1N.c17noc(C)n1.[C@@H]57CC.C26=O.N24.N35
|
C=C(C)CCC(=O)N1CC[C@@H](NC(=O)CC2CC=CC2)C1(C)C
|
C=CC)CCC=O)NCC[C@@H]NC=O)CCCC=CC5))))))))C5C)C
|
[C][=C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][C][C][C][=C][C][Ring1][Branch1][C][Ring1][=C][Branch1][C][C][C]
|
N13CC[C@@H]5C1(C)C.C=C(C)CCC3=O.C16CC=CC1.C4(=O)C6.N45
|
CC(C)(C)OC(=O)N1CC=C[C@H]1COC(=O)c1cc(-c2ccoc2)on1
|
CCC)C)OC=O)NCC=C[C@H]5COC=O)ccc-cccoc5)))))on5
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][=C][C@H1][Ring1][Branch1][C][O][C][=Branch1][C][=O][C][C][=C][Branch1][Branch2][C][C][=C][O][C][=Ring1][Branch1][O][N][=Ring1][#Branch2]
|
N15CC=C[C@H]19.c18cc%10on1.c1%10ccoc1.CC6(C)C.C35=O.C48=O.O36.C79.O47
|
COCC(C)(C)CC(=O)N[C@H]1C[C@H](CC(=O)NC[C@H](O)CF)C1
|
COCCC)C)CC=O)N[C@H]C[C@H]CC=O)NC[C@H]O)CF)))))))C4
|
[C][O][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][=C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][F][C][Ring1][=N]
|
C4C(C)(C)CC2=O.[C@H]16C[C@H]7C1.C5[C@H](O)CF.C7C3=O.CO4.N26.N35
|
COC1(OC)CC[C@H]1C(=O)NC1CC2(C1)CN(C(=O)c1cc(C)c(C)c(F)c1)C2
|
COCOC))CC[C@H]4C=O)NCCCC4)CNC=O)cccC)cC)cF)c6)))))))C4
|
[C][O][C][Branch1][Ring1][O][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch1][C][C][C][Branch1][C][F][=C][Ring1][=Branch2][C][Ring1][S]
|
c19cc(C)c(C)c(F)c1.C17CC2(C1)CN4C2.C156CC[C@H]18.C38=O.C49=O.CO5.O6C.N37
|
CC1CCN(CCC(=O)N[C@@H]2CC[C@@](C)(CNC(=O)c3c[nH]nc3F)C2)CC1
|
CCCCNCCC=O)N[C@@H]CC[C@@]C)CNC=O)cc[nH]nc5F)))))))))C5)))))))))CC6
|
[C][C][C][C][N][Branch2][Ring2][C][C][C][C][=Branch1][C][=O][N][C@@H1][C][C][C@@][Branch1][C][C][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][NH1][N][=C][Ring1][Branch1][F][C][Ring1][S][C][C][Ring2][Ring1][O]
|
CC1CCN6CC1.[C@@H]18CC[C@]%10(C)C1.c19c[nH]nc1F.C6CC4=O.C59=O.N48.C7%10.N57
|
C/C=C(\C)C(=O)N(CCNC(=O)c1ccc2c(c1)OCCO2)C1CCCCC1
|
C/C=C\C)C=O)NCCNC=O)cccccc6)OCCO6)))))))))))))CCCCCC6
|
[C][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][C][C][C][C][C][Ring1][=Branch1]
|
c18ccc2c(c1)OCCO2.C17CCCCC1.C=9(C)C3=O.N357.C5C6.C48=O.CC=9.N46
|
Cc1cc(-n2nc(CCOc3ccccc3)nc2[C@@H]2CC=CC[C@H]2C)ccc1Cl
|
Cccc-nncCCOcccccc6)))))))))nc5[C@@H]CC=CC[C@H]6C))))))))))))ccc6Cl
|
[C][C][=C][C][Branch2][Ring1][=C][N][N][=C][Branch1][N][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][=C][C@@H1][C][C][=C][C][C@H1][Ring1][=Branch1][C][=C][C][=C][Ring2][Ring1][O][Cl]
|
Cc1cc7ccc1Cl.n17nc6nc18.[C@@H]18CC=CC[C@H]1C.c15ccccc1.C6C4.O45
|
O=C(C=Cc1ccsc1)NCC[C@H](O)CNC(=O)[C@]1(O)CCc2ccccc2C1
|
O=CC=Ccccsc5)))))))NCC[C@H]O)CNC=O)[C@]O)CCcccccc6C%10
|
[O][=C][Branch1][#Branch2][C][=C][C][C][=C][S][C][=Ring1][Branch1][N][C][C][C@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C@][Branch1][C][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O]
|
[C@@]17(O)CCc2ccccc2C1.C=8c1ccsc1.C5C[C@H](O)C6.O=C3C=8.C47=O.N35.N46
|
C[C@@H]1CC=C(C(=O)N2CC[C@H](N(C)C(=O)Cn3ccc(Br)n3)C2)CC1
|
C[C@@H]CC=CC=O)NCC[C@H]NC)C=O)CncccBr)n5))))))))C5))))))CC6
|
[C][C@@H1][C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch2][Ring1][Ring2][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][=C][C][Branch1][C][Br][=N][Ring1][=Branch1][C][Ring1][S][C][C][Ring2][Ring1][Branch2]
|
C[C@@H]1CC=C(C4=O)CC1.N14CC[C@H]6C1.n17ccc(Br)n1.C5(=O)C7.N56C
|
O=C(c1ccc(S(=O)(=O)Nc2nccs2)cc1)N1CCc2cccc(Cl)c2C1
|
O=CccccS=O)=O)Ncnccs5)))))))cc6))))))NCCcccccCl)c6C%10
|
[O][=C][Branch2][Ring1][#Branch2][C][=C][C][=C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=N][C][=C][S][Ring1][Branch1][C][=C][Ring1][#C][N][C][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][Ring1][O]
|
N13CCc2cccc(Cl)c2C1.c16ccc(S4(=O)=O)cc1.c15nccs1.O=C36.N45
|
N#Cc1csc(C(=O)NC[C@@H]2CCN(C(=O)CCSc3ccccc3Cl)C2)c1
|
N#CccscC=O)NC[C@@H]CCNC=O)CCScccccc6Cl)))))))))))C5))))))))c5
|
[N][#C][C][=C][S][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C@@H1][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Ring1][P][=C][Ring2][Ring1][#Branch2]
|
N#Cc1csc8c1.c1%10ccccc1Cl.[C@@H]19CCN5C1.C5(=O)CC7.C48=O.N46.C69.S7%10
|
CC[C@H](CC(=O)NCCCCCC(=O)N1C[C@H](C)c2ncccc21)C1CC1
|
CC[C@H]CC=O)NCCCCCC=O)NC[C@H]C)cncccc69))))))))))))))))))CCC3
|
[C][C][C@H1][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][=N][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][C][C][Ring1][Ring1]
|
N14C[C@H](C)c2ncccc21.C5CCCCC4=O.CC[C@@H]6CC3=O.C16CC1.N35
|
Cc1c(O)ccc(C(=O)N[C@H]2C[C@H](O)CN(C(=O)C3(CC4CC4)CC3)C2)c1C
|
CccO)cccC=O)N[C@H]C[C@H]O)CNC=O)CCCCC3))))CC3))))C6))))))))c6C
|
[C][C][=C][Branch1][C][O][C][=C][C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C@H1][C][C@H1][Branch1][C][O][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][Ring1][#Branch1][C][Ring1][S][=C][Ring2][Ring1][#Branch2][C]
|
Cc1c(O)ccc9c1C.[C@H]17C[C@H](O)CN6C1.C18%10CC1.C59=O.C68=O.C1%11CC1.N57.C%10%11
|
CSCC1(CC(=O)NC[C@@H](O)CNC(=O)c2cc(F)ccc2C)CC1
|
CSCCCC=O)NC[C@@H]O)CNC=O)cccF)ccc6C)))))))))))))))CC3
|
[C][S][C][C][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][C][C][Ring2][Ring1][=Branch1]
|
c18cc(F)ccc1C.C5[C@@H](O)C6.C19%10CC1.C%10C3=O.C48=O.CS7.C79.N35.N46
|
O=C(Cc1ccccc1Cl)NC1(CCNC(=O)[C@@H]2C[C@H]2[C@@H]2CCCO2)CCC1
|
O=CCcccccc6Cl))))))))NCCCNC=O)[C@@H]C[C@H]3[C@@H]CCCO5))))))))))))CCC4
|
[O][=C][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@H1][Ring1][Ring1][C@@H1][C][C][C][O][Ring1][Branch1][C][C][C][Ring1][P]
|
c19ccccc1Cl.C158CCC1.[C@@H]1%10CCCO1.O=C3C9.[C@@H]17C[C@H]1%10.C8C6.C47=O.N35.N46
|
CC1(C(=O)NC[C@@](C)(NC(=O)C2CCC2)C2CCC2)CCC(O)CC1
|
CCC=O)NC[C@@]C)NC=O)CCCC4))))))CCCC4))))))))CCCO)CC6
|
[C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][N][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][C][C][Ring1][Ring2][C][C][C][Branch1][C][O][C][C][Ring2][Ring1][Branch2]
|
CC17CCC(O)CC1.C5[C@@]69C.C18CCC1.C19CCC1.C37=O.C48=O.N35.N46
|
COCc1cccc(-n2cc([C@@H]3CCN3C(=O)c3cccc4nc[nH]c34)nn2)c1
|
COCccccc-ncc[C@@H]CCN4C=O)cccccnc[nH]c95))))))))))))))nn5)))))c6
|
[C][O][C][C][=C][C][=C][C][Branch2][Ring2][Ring1][N][C][=C][Branch2][Ring1][Branch2][C@@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][C][N][=C][NH1][C][Ring1][=Branch2][=Ring1][Branch1][N][=N][Ring2][Ring1][Ring2][=C][Ring2][Ring1][#Branch2]
|
c17cccc2nc[nH]c12.c18cccc9c1.n19cc%10nn1.[C@@H]1%10CCN15.C57=O.CO6.C68
|
O=C(c1ccsc1)N1CC[C@H](N2CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)C1
|
O=Ccccsc5)))))NCC[C@H]NCCNC=O)[C@@H]Ccccccc6N9))))))))))CC6))))))C5
|
[O][=C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][N][C][C][C@H1][Branch2][Ring1][=N][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][Ring1][P][C][Ring2][Ring1][=Branch1]
|
[C@@H]18Cc2ccccc2N1.N17CCN6CC1.N15CC[C@H]7C1.c19ccsc1.O=C59.C68=O
|
CCc1[nH]ccc1C(=O)NC1(CNC(=O)C[C@H]2CCC[C@H](C)C2)CC(OC)C1
|
CCc[nH]ccc5C=O)NCCNC=O)C[C@H]CCC[C@H]C)C6))))))))))CCOC))C4
|
[C][C][C][NH1][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C@H1][C][C][C][C@H1][Branch1][C][C][C][Ring1][#Branch1][C][C][Branch1][Ring1][O][C][C][Ring2][Ring1][C]
|
[C@H]1%11CCC[C@H](C)C1.c19[nH]ccc18.C16%10CC5C1.C4(=O)C%11.C38=O.CC9.N36.C7%10.N47.O5C
|
O=C(CCN1CCOCC1)N1CCCC[C@H](C(=O)N2CCCC(F)(F)C2)C1
|
O=CCCNCCOCC6))))))))NCCCC[C@H]C=O)NCCCCF)F)C6)))))))C7
|
[O][=C][Branch1][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][N][C][C][C][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][Branch2][C][Ring1][P]
|
N13CCCC[C@H]6C1.N14CCCC(F)(F)C1.N15CCOCC1.O=C3CC5.C46=O
|
C/C(I)=C/C(=O)N1CC(O)(CNC(=O)c2ccnc(CO)c2)C1
|
C/CI)=C/C=O)NCCO)CNC=O)cccncCO))c6)))))))))C4
|
[C][/C][Branch1][C][I][=C][/C][=Branch1][C][=O][N][C][C][Branch1][C][O][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][Ring1][C][O][=C][Ring1][Branch2][C][Ring1][P]
|
c16ccnc8c1.N13CC9(O)C1.C=7C3=O.CC=7I.C46=O.C59.N45.C8O
|
CCNC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)ONC(=O)[C@H](CC)C(=O)OC
|
CCNC=O)CC)C)NC=O)[C@H]CCC)C)))ONC=O)[C@H]CC))C=O)OC
|
[C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][O][C]
|
O4NC(=O)[C@H](CC)C1=O.C3(=O)[C@@H]4CC(C)C.C2(=O)C6(C)C.CC5.N25.N36.O1C
|
Cc1occc1[C@@H](C(=O)N[C@H]1CCOC1)N1CCN(C(=O)N2CCCCC2)CC1
|
Ccoccc5[C@@H]C=O)N[C@H]CCOC5)))))))NCCNC=O)NCCCCC6)))))))CC6
|
[C][C][O][C][=C][C][=Ring1][Branch1][C@@H1][Branch1][=N][C][=Branch1][C][=O][N][C@H1][C][C][O][C][Ring1][Branch1][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][=C]
|
N16CCN4CC1.Cc1occc18.N15CCCCC1.[C@H]68C3=O.[C@H]17CCOC1.C45=O.N37
|
Cc1ccc(CC(=O)N2CCN(C(=O)[C@H]3CCCCO3)C[C@H]2C(F)F)s1
|
CccccCC=O)NCCNC=O)[C@H]CCCCO6)))))))C[C@H]6CF)F))))))))))s5
|
[C][C][=C][C][=C][Branch2][Ring1][P][C][C][=Branch1][C][=O][N][C][C][N][Branch1][=N][C][=Branch1][C][=O][C@H1][C][C][C][C][O][Ring1][=Branch1][C][C@H1][Ring1][=C][C][Branch1][C][F][F][S][Ring2][Ring1][=Branch2]
|
N14CCN5C[C@H]17.Cc1ccc8s1.[C@H]16CCCCO1.C8C4=O.C56=O.C7(F)F
|
CO[C@H](CNC(=O)c1cc2n(n1)CCCO2)CNC(=O)c1ccc(CC(C)C)s1
|
CO[C@H]CNC=O)cccnn5)CCCO6)))))))))))CNC=O)ccccCCC)C)))s5
|
[C][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][C][O][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][C][C][Branch1][C][C][C][S][Ring1][=Branch2]
|
c18cc2n(n1)CCCO2.c19ccc%10s1.[C@@H]5(C6)C7.C%10C(C)C.C38=O.C49=O.CO5.N36.N47
|
C=CCCC(=O)N(CCNC(=O)c1cnn([C@@H](C)C(C)C)c1C)C[C@@H](C)O
|
C=CCCC=O)NCCNC=O)ccnn[C@@H]C)CC)C)))c5C))))))))))C[C@@H]C)O
|
[C][=C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][O][C][C][N][C][=Branch1][C][=O][C][C][=N][N][Branch1][#Branch2][C@@H1][Branch1][C][C][C][Branch1][C][C][C][C][=Ring1][#Branch2][C][C][C@@H1][Branch1][C][C][O]
|
c17cnn8c1C.C=CCCC2=O.[C@H]8(C)C(C)C.C6[C@@H](C)O.N246.C4C5.C37=O.N35
|
CCCN(CCNC(=O)C[C@@H]1CCC(F)(F)C1)C(=O)C[C@H](C)c1c(C)n[nH]c1C
|
CCCNCCNC=O)C[C@@H]CCCF)F)C5))))))))))C=O)C[C@H]C)ccC)n[nH]c5C
|
[C][C][C][N][Branch2][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][=Branch1][C][=O][C][C@H1][Branch1][C][C][C][C][Branch1][C][C][=N][NH1][C][=Ring1][=Branch1][C]
|
[C@@H]17CCC(F)(F)C1.c18c(C)n[nH]c1C.C3(=O)C[C@@H]8C.C2(=O)C7.CCC4.N345.C5C6.N26
|
Cc1ccc(C(=O)N2C[C@H](O)C[C@H]2CNC(=O)[C@@H]2CCC(=O)N2)c(Cl)c1
|
CccccC=O)NC[C@H]O)C[C@H]5CNC=O)[C@@H]CCC=O)N5))))))))))))))cCl)c6
|
[C][C][=C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][=Branch2]
|
Cc1ccc7c(Cl)c1.N13C[C@H](O)C[C@H]18.[C@@H]16CCC(=O)N1.C37=O.C46=O.C58.N45
|
Cc1ncc(Cl)cc1CC(=O)NCC1(NC(=O)CC(C)C)CC1
|
CcnccCl)cc6CC=O)NCCNC=O)CCC)C)))))CC3
|
[C][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][N][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][C][Ring1][#Branch2]
|
Cc1ncc(Cl)cc17.C3(=O)CC(C)C.C7C2=O.C156CC1.N24.C46.N35
|
Cc1cc(C(=O)N2C[C@H](C)[C@H](NC(=O)C3(O)CCCCC3)C2)c[nH]1
|
CcccC=O)NC[C@H]C)[C@H]NC=O)CO)CCCCC6))))))))C5))))))c[nH]5
|
[C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][Branch1][C][O][C][C][C][C][C][Ring1][#Branch1][C][Ring1][S][=C][NH1][Ring2][Ring1][#Branch1]
|
N14C[C@@H]6[C@@H](C)C1.C17(O)CCCCC1.Cc1cc8c[nH]1.C48=O.C57=O.N56
|
C[C@@H]1CC[C@@H](CC(=O)N[C@@H]2[C@H]3C[C@@H]2N(C(=O)C2(c4cc[nH]n4)CCC2)C3)C1
|
C[C@@H]CC[C@@H]CC=O)N[C@@H][C@H]C[C@@H]4NC=O)Cccc[nH]n5)))))CCC4)))))C5)))))))))C5
|
[C][C@@H1][C][C][C@@H1][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C@@H1][C@H1][C][C@@H1][Ring1][Ring2][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][C][C][C][Ring1][=Branch2][C][Ring1][S][C][Ring2][Ring1][#Branch2]
|
[C@@H]17[C@H]2C[C@@H]1N6C2.C[C@@H]1CC[C@@H]9C1.C18%10CCC1.c1%10cc[nH]n1.C9C5=O.C68=O.N57
|
Cc1ccnn1[C@H](C)C(=O)N1CCN(C(=O)[C@@H](C)c2ccccc2F)[C@H](CO)C1
|
Ccccnn5[C@H]C)C=O)NCCNC=O)[C@@H]C)cccccc6F)))))))))[C@H]CO))C6
|
[C][C][=C][C][=N][N][Ring1][Branch1][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C@H1][Branch1][Ring1][C][O][C][Ring2][Ring1][Ring1]
|
N13CCN4[C@H]6C1.c17ccccc1F.Cc1ccnn15.[C@@H]5(C)C3=O.C4(=O)[C@H]7C.C6O
|
CC[C@@H]1CCO[C@@H]1C(=O)NC[C@H](CO)NC(=O)CCNc1ccccn1
|
CC[C@@H]CCO[C@@H]5C=O)NC[C@H]CO))NC=O)CCNcccccn6
|
[C][C][C@@H1][C][C][O][C@@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][C][N][C][=C][C][=C][C][=N][Ring1][=Branch1]
|
[C@@H]19CCO[C@@H]18.c17ccccn1.C4[C@@H]5CO.C3(=O)CC6.C28=O.CC9.N24.N35.N67
|
CN(CCCCCCNC(=O)C(F)(F)c1ccc(F)cn1)C(=O)Cc1cccs1
|
CNCCCCCCNC=O)CF)F)ccccF)cn6)))))))))))))))C=O)Cccccs5
|
[C][N][Branch2][Ring1][=C][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][S][Ring1][Branch1]
|
C4CCCCC5.c16ccc(F)cn1.C2(=O)C6(F)F.c17cccs1.C3(=O)C7.CN34.N25
|
CCN1CC[C@@H]1C(=O)NCCO[C@@H]1CCN(C(=O)Cc2cccnc2O)C1
|
CCNCC[C@@H]4C=O)NCCO[C@@H]CCNC=O)Cccccnc6O)))))))))C5
|
[C][C][N][C][C][C@@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][O][C@@H1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][Ring1][#C]
|
c1%10cccnc1O.[C@@H]16CCN4C1.N17CC[C@@H]19.C4(=O)C%10.C39=O.C8C5.CC7.N38.O56
|
C[C@H](CC1CN(C(=O)[C@@H](C)Cc2cnc[nH]2)C1)NC(=O)CCc1cnccn1
|
C[C@H]CCCNC=O)[C@@H]C)Cccnc[nH]5))))))))C4)))))NC=O)CCccnccn6
|
[C][C@H1][Branch2][Ring1][#Branch2][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=C][N][=C][NH1][Ring1][Branch1][C][Ring1][=C][N][C][=Branch1][C][=O][C][C][C][=C][N][=C][C][=N][Ring1][=Branch1]
|
C3(=O)[C@@H](C)C6.c17cnccn1.C18CN3C1.c16cnc[nH]1.C4(=O)CC7.C[C@@H]5C8.N45
|
CC(C)c1cc(C(=O)NCc2cn(CC(=O)N3CC(C)(CO)C3)nn2)no1
|
CCC)cccC=O)NCccnCC=O)NCCC)CO))C4))))))nn5))))))))no5
|
[C][C][Branch1][C][C][C][=C][C][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C][C][=C][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][Ring1][C][O][C][Ring1][#Branch1][N][=N][Ring1][#C][=N][O][Ring2][Ring1][Branch2]
|
c19cc7no1.c1%10cn8nn1.N15CC%11(C)C1.C8C5=O.CC9C.C47=O.N46.C6%10.C%11O
|
Cc1nccc(N(CC2(O)CNC2)C(=O)/C=C/c2ccc(F)cc2F)n1
|
CcncccNCCO)CNC4)))))C=O)/C=C/ccccF)cc6F)))))))))))n6
|
[C][C][=N][C][=C][C][Branch2][Ring1][S][N][Branch1][O][C][C][Branch1][C][O][C][N][C][Ring1][Branch1][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][=N][Ring2][Ring1][=Branch2]
|
C=6c1ccc(F)cc1F.Cc1nccc5n1.C17(O)CNC1.C3(=O)C=6.N345.C47
|
COC(=O)CCNC(=O)[C@@H]1C[C@]12CCN(C(=O)c1cnsc1C)C2
|
COC=O)CCNC=O)[C@@H]C[C@]3CCNC=O)ccnsc5C)))))))C5
|
[C][O][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@][Ring1][Ring1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][=N][S][C][=Ring1][Branch1][C][C][Ring1][=N]
|
[C@@H]17C[C@]12CCN5C2.c18cnsc1C.C3(=O)CC6.C47=O.C58=O.CO3.N46
|
CCC(C)(C)N[C@@H](c1cnn(C)c1C)c1nnnn1C1CC(C(=O)OC)C1
|
CCCC)C)N[C@@H]ccnnC)c5C))))))cnnnn5CCCC=O)OC)))C4
|
[C][C][C][Branch1][C][C][Branch1][C][C][N][C@@H1][Branch1][N][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][=N][N][=N][N][Ring1][Branch1][C][C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Ring1][Branch2]
|
c17cnn(C)c1C.c16nnnn18.CCC3(C)C.C18CC5C1.[C@@H]467.C25=O.N34.O2C
|
CC[C@@H](SC)C(=O)N[C@H]1COC2(C1)CN(C(=O)c1cncc(C)n1)C2
|
CC[C@@H]SC))C=O)N[C@H]COCC5)CNC=O)ccnccC)n6)))))))C4
|
[C][C][C@@H1][Branch1][Ring1][S][C][C][=Branch1][C][=O][N][C@H1][C][O][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][C][=N][Ring1][#Branch1][C][Ring1][=C]
|
[C@H]16COC2(C1)CN4C2.c17cncc(C)n1.CC[C@@H]5C3=O.C47=O.S5C.N36
|
CC(C)[C@H](C(=O)N1C[C@H](C)C[C@@H](CNC(=O)CCc2cn(C)nn2)C1)C1CCC1
|
CCC)[C@H]C=O)NC[C@H]C)C[C@@H]CNC=O)CCccnC)nn5))))))))))C6)))))))CCCC4
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][C@@H1][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][C][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1][C][Ring2][Ring1][Ring1][C][C][C][C][Ring1][Ring2]
|
N13C[C@H]8C[C@@H](C)C1.CC(C)[C@@H]7C3=O.c16cn(C)nn1.C4(=O)CC6.C17CCC1.C58.N45
|
C[C@@H]1C=C(C(=O)NC[C@@H](C)NC(=O)[C@H](CO)N(C)C)CC1
|
C[C@@H]C=CC=O)NC[C@@H]C)NC=O)[C@H]CO))NC)C)))))))))CC5
|
[C][C@@H1][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][Branch1][C][C][C][C][C][Ring2][Ring1][Ring2]
|
C[C@@H]1C=C(C2=O)CC1.C3(=O)[C@@H]6CO.C4[C@H]5C.N6(C)C.N24.N35
|
C=CCO[C@H](C)C(=O)N1C[C@@H]2CC[C@H](C1)[C@H](NC(=O)Cc1ccccc1SC)C2
|
C=CCO[C@H]C)C=O)NC[C@@H]CC[C@H]C7)[C@H]NC=O)Ccccccc6SC)))))))))))C6
|
[C][=C][C][O][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@H1][Branch1][Ring2][C][Ring1][#Branch1][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][C][Ring2][Ring1][Ring1]
|
N13C[C@@H]2CC[C@H](C1)[C@H]7C2.c18ccccc19.[C@@H]6(C)C3=O.C4(=O)C8.C=CC5.O56.N47.S9C
|
C=C[C@H](CC)CC(=O)N1CC(CCNC(=O)c2ccc(C(C)=O)cc2)C1
|
C=C[C@H]CC))CC=O)NCCCCNC=O)ccccCC)=O))cc6))))))))))C4
|
[C][=C][C@H1][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][C][=C][Ring1][=Branch2][C][Ring2][Ring1][C]
|
C=C[C@H](CC)CC3=O.c16ccc7cc1.N13CC8C1.C8C5.C46=O.C7(C)=O.N45
|
C[C@@H]1CCN(C(=O)C=Cc2ncc[nH]2)[C@@H](C)[C@H]1NC(=O)CCC(F)(F)CN=[N+]=[N-]
|
C[C@@H]CCNC=O)C=Ccncc[nH]5))))))))[C@@H]C)[C@H]6NC=O)CCCF)F)CN=[N+]=[N-]
|
[C][C@@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=N][C][=C][NH1][Ring1][Branch1][C@@H1][Branch1][C][C][C@H1][Ring1][S][N][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][C][N][=N+1][=N-1]
|
C4(=O)CCC(F)(F)CN=[N+]=[N-].C[C@@H]1CCN3[C@@H](C)[C@H]15.C=6c1ncc[nH]1.C3(=O)C=6.N45
|
CCCc1cc(C(=O)N(C)[C@H]2CCCN(C(=O)c3cc(C(N)=O)cs3)C2)sc1C
|
CCCcccC=O)NC)[C@H]CCCNC=O)cccCN)=O))cs5))))))C6))))))))sc5C
|
[C][C][C][C][C][=C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][S][Ring1][Branch2][C][Ring1][S][S][C][=Ring2][Ring1][=Branch2][C]
|
c1%10cc7sc1C.[C@H]16CCCN5C1.c18cc9cs1.CCC%10.C47=O.N46C.C58=O.C9(N)=O
|
CC(=O)c1cc(C(=O)N[C@@H]2CN(C(=O)c3ncc(Br)cn3)C(C)(C)C2)co1
|
CC=O)cccC=O)N[C@@H]CNC=O)cnccBr)cn6)))))))CC)C)C5)))))))co5
|
[C][C][=Branch1][C][=O][C][=C][C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=N][C][=C][Branch1][C][Br][C][=N][Ring1][#Branch1][C][Branch1][C][C][Branch1][C][C][C][Ring1][S][=C][O][Ring2][Ring1][Branch2]
|
[C@@H]16CN5C(C)(C)C1.c18ncc(Br)cn1.c17cc9co1.CC7=O.C49=O.C58=O.N46
|
c1ccc(-c2cnc([C@H]3CCCCN3Cc3n[nH]c4cccnc34)[nH]2)cc1
|
cccc-ccnc[C@H]CCCCN6Ccn[nH]ccccnc96))))))))))))))))[nH]5)))))cc6
|
[C][=C][C][=C][Branch2][Ring2][C][C][=C][N][=C][Branch2][Ring1][#Branch1][C@H1][C][C][C][C][N][Ring1][=Branch1][C][C][=N][NH1][C][=C][C][=C][N][=C][Ring1][=Branch2][Ring1][=Branch1][NH1][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][O]
|
c16n[nH]c2cccnc12.[C@H]17CCCCN15.c1ccc8cc1.c18cnc7[nH]1.C56
|
CC[C@H](CNC(=O)Cc1cc(COC)on1)NC(=O)c1cc(N)c(OC)cc1F
|
CC[C@H]CNC=O)CcccCOC)))on5)))))))))NC=O)cccN)cOC))cc6F
|
[C][C][C@H1][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C][C][=C][Branch1][Ring2][C][O][C][O][N][=Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][N][=C][Branch1][Ring1][O][C][C][=C][Ring1][=Branch2][F]
|
c18cc(N)c5cc1F.c19cc%10on1.CC[C@@H]6C7.C2(=O)C9.C38=O.N27.C4%10.O4C.N36.O5C
|
CC[C@H](CO)NC(=O)/C(C)=C/CNC(=O)[C@@H](C)n1cccc1
|
CC[C@H]CO))NC=O)/CC)=C/CNC=O)[C@@H]C)ncccc5
|
[C][C][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][/C][Branch1][C][C][=C][/C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][N][C][=C][C][=C][Ring1][Branch1]
|
CC[C@@H]4CO.C2(=O)C=6C.C3(=O)[C@H]7C.n17cccc1.C=6C5.N24.N35
|
Cc1cc(=NC[C@H]2COC[C@@H]2N(C)C)[nH]c(N[C@H](C)C(F)F)n1
|
Cccc=NC[C@H]COC[C@@H]5NC)C)))))))))[nH]cN[C@H]C)CF)F))))n6
|
[C][C][=C][C][=Branch1][#C][=N][C][C@H1][C][O][C][C@@H1][Ring1][Branch1][N][Branch1][C][C][C][NH1][C][Branch1][O][N][C@H1][Branch1][C][C][C][Branch1][C][F][F][=N][Ring2][Ring1][=Branch1]
|
Cc1cc(=NC6)[nH]c4n1.[C@H]16COC[C@@H]15.[C@@H]3(C)C(F)F.N5(C)C.N34
|
COCC(=O)N1CCOC[C@@H]1CN(C)C(=O)Cn1cc(C2CC2)cn1
|
COCC=O)NCCOC[C@@H]6CNC)C=O)CnccCCC3)))cn5
|
[C][O][C][C][=Branch1][C][=O][N][C][C][O][C][C@@H1][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=N][Ring1][Branch2]
|
N13CCOC[C@@H]18.n17cc9cn1.C5C3=O.C4(=O)C7.N46C.C19CC1.CO5.C68
|
CCOC(=O)[C@@H](C(=O)N[C@@H]1CN(C(=O)CNC(=O)NC)CC[C@H]1F)C(C)(C)C
|
CCOC=O)[C@@H]C=O)N[C@@H]CNC=O)CNC=O)NC))))))CC[C@H]6F)))))))))CC)C)C
|
[C][C][O][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][=C][F][C][Branch1][C][C][Branch1][C][C][C]
|
C2(=O)[C@@H](C3=O)C(C)(C)C.[C@@H]19CN4CC[C@H]1F.C4(=O)C8.C56=O.CC7.O27.N39.N58.N6C
|
O=C(C[C@H]1COCCN1C(=O)c1ccc(O)cc1O)N1C[C@@H](O)[C@@H](F)C1
|
O=CC[C@H]COCCN6C=O)ccccO)cc6O)))))))))))))))NC[C@@H]O)[C@@H]F)C5
|
[O][=C][Branch2][Ring1][#Branch2][C][C@H1][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][N][C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][F][C][Ring1][#Branch1]
|
c14ccc(O)cc1O.[C@H]15COCCN13.N12C[C@@H](O)[C@@H](F)C1.O=C2C5.C34=O
|
CCCCC[C@H](CC)C(=O)N1CC[C@@H](C(=O)N2CCC3(CC(F)C3)C2)C1
|
CCCCC[C@H]CC))C=O)NCC[C@@H]C=O)NCCCCCF)C4)))C5))))))C5
|
[C][C][C][C][C][C@H1][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C@@H1][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][=Branch2][C][C][Branch1][C][F][C][Ring1][Branch1][C][Ring1][=Branch2][C][Ring1][S]
|
CCCCC[C@H](CC)C4=O.N15CCC2(CC(F)C2)C1.N14CC[C@@H]6C1.C56=O
|
C=C(Br)CC(=O)NC[C@]1(C)CCCN(C(=O)C=Cc2cc[nH]n2)C1
|
C=CBr)CC=O)NC[C@]C)CCCNC=O)C=Cccc[nH]n5))))))))C6
|
[C][=C][Branch1][C][Br][C][C][=Branch1][C][=O][N][C][C@][Branch1][C][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][C][=C][NH1][N][=Ring1][Branch1][C][Ring1][S]
|
[C@@]17(C)CCCN4C1.C=C(Br)CC3=O.C=6c1cc[nH]n1.C4(=O)C=6.N35.C57
|
CCc1oncc1C(=O)N[C@@H]1CN(C(=O)[C@@H]2CCN(C)C(=O)C2)CC[C@@H]1C
|
CCconcc5C=O)N[C@@H]CNC=O)[C@@H]CCNC)C=O)C6)))))))CC[C@@H]6C
|
[C][C][C][O][N][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Ring1][Branch2][C][C][C@@H1][Ring1][S][C]
|
[C@@H]15CN4CC[C@@H]1C.[C@@H]16CCN(C)C(=O)C1.c18oncc17.C37=O.C46=O.CC8.N35
|
CC1(CNC2(c3ccc(C(C)(C)C)cc3)CC2)CCCCCC1
|
CCCNCccccCC)C)C))cc6))))))CC3)))))CCCCCC7
|
[C][C][Branch2][Ring1][=N][C][N][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][C][Ring1][=N][C][C][C][C][C][C][Ring2][Ring1][=Branch1]
|
CC16CCCCCC1.c18ccc7cc1.C158CC1.C7(C)(C)C.C46.N45
|
CCC1=NO[C@@H](C(=O)N2CCC[C@@H]2CN(C)C(=O)CC(C)(C)C(F)(F)F)C1
|
CCC=NO[C@@H]C=O)NCCC[C@@H]5CNC)C=O)CCC)C)CF)F)F)))))))))))))C5
|
[C][C][C][=N][O][C@@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring2][Ring1][=Branch2]
|
C4(=O)CC(C)(C)C(F)(F)F.CCC1=NO[C@@H]6C1.N13CCC[C@@H]17.C36=O.N45C.C57
|
CCc1cc(N)ccc1C(=O)NCCCN(CC)C(=O)c1cc2ccncc2[nH]1
|
CCcccN)ccc6C=O)NCCCNCC))C=O)cccccncc6[nH]9
|
[C][C][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=N][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2]
|
c18cc2ccncc2[nH]1.c1%10cc(N)ccc19.C5CC6.C39=O.N467.C48=O.CC%10.N35.C7C
|
C[C@@H]1CC[C@H](CNC(=O)C2=C(Cl)CCC2)N(C(=O)CCC(=O)NN(C)C)C1
|
C[C@@H]CC[C@H]CNC=O)C=CCl)CCC5))))))))NC=O)CCC=O)NNC)C)))))))C6
|
[C][C@@H1][C][C][C@H1][Branch1][P][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][C][C][Ring1][=Branch1][N][Branch1][P][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][N][Branch1][C][C][C][C][Ring2][Ring1][#Branch2]
|
C4(=O)CCC(=O)NN(C)C.C[C@@H]1CC[C@H]6N4C1.C3(=O)C1=C(Cl)CCC1.C56.N35
|
CCN(C)CC(=O)N1CC(OCC(=O)N(C)CCCOC(C)C)C1
|
CCNC)CC=O)NCCOCC=O)NC)CCCOCC)C))))))))))C4
|
[C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][O][C][Branch1][C][C][C][C][Ring1][P]
|
N12CC7C1.C9C2=O.C4C3=O.C%10CC5.N89C.N3%10C.C6(C)C.CC8.O47.O56
|
CCCCCCN(C)CC(=O)NCC1(OC)CN(C(=O)[C@@]2(Cl)CC2(F)F)C1
|
CCCCCCNC)CC=O)NCCOC))CNC=O)[C@@]Cl)CC3F)F)))))C4
|
[C][C][C][C][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@][Branch1][C][Cl][C][C][Ring1][Ring2][Branch1][C][F][F][C][Ring1][=C]
|
CCCCCC6.C15%10CN4C1.[C@]19(Cl)CC1(F)F.C7C3=O.N67C.C49=O.N38.C8%10.O5C
|
CCCCC[C@@H](O)CC(=O)N[C@@H]1CN(C(=O)C(C)(C)C(F)(F)F)CC2(CC2)C1
|
CCCCC[C@@H]O)CC=O)N[C@@H]CNC=O)CC)C)CF)F)F))))CCCC3))C6
|
[C][C][C][C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][F][Branch1][C][F][F][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][Ring1][P]
|
CCCCC[C@@H](O)CC3=O.[C@@H]15CN4CC2(CC2)C1.C4(=O)C(C)(C)C(F)(F)F.N35
|
CCC(CC)c1cn(C2C[C@H]3CC[C@@H](C2)N3C(=O)[C@@H]2C=CCC2)nn1
|
CCCCC))ccnCC[C@H]CC[C@@H]C7)N5C=O)[C@@H]C=CCC5)))))))))))))nn5
|
[C][C][C][Branch1][Ring1][C][C][C][=C][N][Branch2][Ring1][#Branch2][C][C][C@H1][C][C][C@@H1][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][C][=C][C][C][Ring1][Branch1][N][=N][Ring2][Ring1][Ring2]
|
C17C[C@H]2CC[C@@H](C1)N24.c16cn7nn1.CCC6CC.[C@@H]15C=CCC1.C45=O
|
C[C@@H]1C[C@@H]1CN(C)C(=O)[C@H]1CC12CCN(C(=O)C1(F)CCCCC1)CC2
|
C[C@@H]C[C@@H]3CNC)C=O)[C@H]CC3CCNC=O)CF)CCCCC6)))))))CC6
|
[C][C@@H1][C][C@@H1][Ring1][Ring1][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][Ring1][Ring1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][Branch1][C][F][C][C][C][C][C][Ring1][#Branch1][C][C][Ring1][#C]
|
[C@H]16CC12CCN4CC2.C17(F)CCCCC1.C[C@@H]1C[C@@H]18.N35C.C36=O.C47=O.C58
|
C[C@H](Oc1ccccc1C#N)C(=O)NC/C=C/C(F)F
|
C[C@H]Occcccc6C#N)))))))))C=O)NC/C=C/CF)F
|
[C][C@H1][Branch1][N][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][#N][C][=Branch1][C][=O][N][C][/C][=C][/C][Branch1][C][F][F]
|
c14ccccc1C#N.C[C@H]3C2=O.C=6C(F)F.C5C=6.O34.N25
|
CCC(=O)N[C@@H](C)C(=O)NC[C@@H]1CCCN1c1nnc(C(N)=O)s1
|
CCC=O)N[C@@H]C)C=O)NC[C@@H]CCCN5cnncCN)=O))s5
|
[C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][N][Ring1][Branch1][C][=N][N][=C][Branch1][=Branch1][C][Branch1][C][N][=O][S][Ring1][Branch2]
|
[C@@H]18CCCN16.c16nnc7s1.[C@H]4(C)C3=O.CCC2=O.C7(N)=O.N24.N35.C58
|
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