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{"compound_id": "LB-3B67F63799F1", "smiles": "CCS(=O)(=O)NCc1ccc(Nc2ncc(C)c(-c3cnn(C(C)C)c3)n2)cc1"}, {"compound_id": "LB-4F85EEC0C718", "smiles": "Cc1cnc(Nc2ccc(CNS(=O)(=O)C3CC3)cc2)nc1-c1cnn(C(C)C)c1"}, {"compound_id": "LB-B95DB21EA8FA", "smiles": "O=C1OC(O)C(NCc2cn(-c3ccc(F)c(F)c3)nn2)=C1Cl"}, {"compound_id": "LB-AFBB1E2C7ADA", "smiles": "COc1ccc(-c2ccn(-c3ccc(NC(=O)Nc4ccc(Cl)c(Cl)c4)cc3)n2)cc1OC"}, {"compound_id": "LB-61AF453BCCC7", "smiles": "COc1ccc(-c2ccn(-c3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)n2)cc1OC"}, {"compound_id": "LB-6D50612F3F30", "smiles": "COc1ccc(N(C)C(=O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2=O)cc1"}, {"compound_id": "LB-4624B2A0B68C", "smiles": "Cc1[nH]c2ccccc2c1CC(=O)[C@@H](Cc1ccccc1)C(=O)N(C)c1ccccc1"}, {"compound_id": "LB-F3ED29C57B88", "smiles": "Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2[C@@H]1CCCN(C(=O)c2ccc(CNc3ccc4c(c3)C(=O)N(C3CCC(=O)NC3=O)C4=O)cc2)C1"}, {"compound_id": "LB-6BE42A8A2E9D", "smiles": 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"C[C@@H]1COCCN1c1nc(-c2cccc3[nH]ccc23)nc2c1CN(C(=O)c1ccc3c(c1)OCO3)C2(C)C"}, {"compound_id": "LB-53C0370144B4", "smiles": "C[C@@H]1COCCN1c1nc(-c2cccc3[nH]ccc23)nc2c1CN(C(=O)c1ccc(S(C)(=O)=O)cc1)C2(C)C"}, {"compound_id": "LB-433A24A064AB", "smiles": "C[C@@H]1COCCN1c1nc(-c2cccc3[nH]ccc23)nc2c1CN(C(=O)c1cccc(S(C)(=O)=O)c1)C2(C)C"}, {"compound_id": "LB-9B63AD9903D7", "smiles": "CC(=O)c1ccc(C(=O)N2Cc3c(N4CCOC[C@H]4C)nc(-c4cccc5[nH]ccc45)nc3C2(C)C)cc1"}, {"compound_id": "LB-694A8754E49F", "smiles": "CC(=O)c1cccc(C(=O)N2Cc3c(N4CCOC[C@H]4C)nc(-c4cccc5[nH]ccc45)nc3C2(C)C)c1"}, {"compound_id": "LB-7EAE2EEA7FAD", "smiles": "Clc1ccc(COn2nnnc2-c2ccc(Cl)cc2)cc1"}, {"compound_id": "LB-494FC338E9B6", "smiles": "Clc1ccc(-c2nnnn2OCc2cccc(Cl)c2)cc1"}, {"compound_id": "LB-3BFD9B8D1539", "smiles": "CNCCN(C)Cc1cncc(-c2ccc(NS(=O)(=O)C3CC3)cc2)c1"}, {"compound_id": "LB-51D63848967D", "smiles": "CN(CCC1CCCCCC1)Cc1c[nH]c2c(OC(=O)N(C)C)cccc12"}, {"compound_id": "LB-E2FD89772EED", "smiles": 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{"compound_id": "LB-0775E43AA43E", "smiles": "CCS(=O)(=O)c1cc(-c2ncccc2C)n2ncc(C3CCCC3)c2n1"}, {"compound_id": "LB-87EF9A0F2258", "smiles": "CCS(=O)(=O)c1cc(-c2ncccc2C)n2ncc(C3CCC(F)(F)CC3)c2n1"}, {"compound_id": "LB-339068263DA8", "smiles": "CCS(=O)(=O)c1cc(-c2ncccn2)n2ncc(C3CCC(F)(F)CC3)c2n1"}, {"compound_id": "LB-B203CE63BB6C", "smiles": "Cc1oc(-c2cccc(C(F)(F)F)c2)cc1C(=O)Nc1nc(CN2CCOCC2)ns1"}, {"compound_id": "LB-6699A14C0755", "smiles": "Cc1nc2ccc(-c3ccnc(N)c3)nc2n1-c1ccc(N2CCN(CC#Cc3ccc(N4CCC(C(=O)N5CCC(n6cc(CNc7cccc8c7C(=O)N(C7CCC(=O)NC7=O)C8=O)cn6)CC5)CC4)nc3)CC2)c(F)c1"}, {"compound_id": "LB-A3E5F9E911A5", "smiles": "O=C1CCC(N2C(=O)c3ccc(N4CCN(CC5CCN(C(=O)c6ccc(-c7cnc8ncc(Cc9ccc%10ncccc%10c9)n8n7)cc6F)CC5)CC4)cc3C2=O)C(=O)N1"}, {"compound_id": "LB-8EB948A6B19D", "smiles": "CNC(=O)c1ccc(-c2cnc3ncc(Cc4ccc5ncccc5c4)n3n2)cc1F"}, {"compound_id": "LB-42AD0303A468", "smiles": "Cn1cc(Nc2ncc(C3CN(C(=O)Nc4ccc(-c5ccccc5)cc4)C3)nc2C(N)=O)cn1"}, {"compound_id": "LB-15E35D4A9B47", "smiles": 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{"compound_id": "LB-94D725D1E7C2", "smiles": "NC1=NC(=O)C2(CCc3ncccc32)c2cc(C(F)(F)F)ccc21"}, {"compound_id": "LB-0B5F3C659A64", "smiles": "[2H]C([2H])([2H])NC1=NC(=O)C2(CCc3ncccc32)c2cc(C(F)(F)F)ccc21"}, {"compound_id": "LB-E2DECA2493E3", "smiles": "[2H]C([2H])([2H])NC1=NC(=O)[C@]2(CCc3ncccc32)c2cc(C(F)(F)F)ccc21"}, {"compound_id": "LB-CDA860A2E4A1", "smiles": "[2H]C([2H])([2H])NC1=NC(=O)[C@]2(CCc3ncccc32)c2cc(C(C)(F)F)ccc21"}, {"compound_id": "LB-CAC0E4346756", "smiles": "[2H]C([2H])([2H])NC1=NC(=O)[C@]2(CCc3ncccc32)c2cc(C(C)(F)F)c(F)cc21"}, {"compound_id": "LB-EA62EAE3CDF4", "smiles": "[2H]C([2H])([2H])NC1=NC(=O)[C@]2(CCc3ncccc32)c2cc(C3CC3)ccc21"}, {"compound_id": "LB-99BA1A216BBC", "smiles": "[2H]C([2H])([2H])NC1=NC(=O)[C@]2(CCc3ncccc32)c2cc(C3CC3)c(F)cc21"}, {"compound_id": "LB-0CCC26F67433", "smiles": "CCCNNC(=O)c1ccc(CNC(=O)c2cnc(-c3ccc4occc4c3)[nH]2)cc1"}, {"compound_id": "LB-D75192B9F547", "smiles": "O=C(Nc1nccs1)c1cccc2[nH]c(-c3ccc(OC(F)F)c(OCC4CC4)c3)nc12"}, {"compound_id": 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"smiles": "C=CC(=O)N1Cc2nc(-c3cc(-c4c(F)cccc4F)c(F)cn3)n(-c3ccncn3)c2C1"}, {"compound_id": "LB-7476899C72FD", "smiles": "C=C(F)C(=O)N1Cc2nc(-c3cc(-c4c(F)cccc4F)c(F)cn3)n(-c3ccncn3)c2C1"}, {"compound_id": "LB-FF027CB07BA7", "smiles": "C=C(Cl)C(=O)N1Cc2nc(-c3cc(-c4c(F)cccc4F)c(F)cn3)n(-c3ccncn3)c2C1"}, {"compound_id": "LB-3AA695A54F57", "smiles": "O=C(/C=C/CF)N1Cc2nc(-c3cc(-c4c(F)cccc4F)c(F)cn3)n(-c3ccncn3)c2C1"}, {"compound_id": "LB-463FE09D7C1E", "smiles": "O=C(/C=C/C(F)(F)F)N1Cc2nc(-c3cc(-c4c(F)cccc4F)c(F)cn3)n(-c3ccncn3)c2C1"}, {"compound_id": "LB-CE5F6ED51EDA", "smiles": "CCc1ccc(NC(=O)Nc2c[nH]c3ccc(F)cc23)cc1"}, {"compound_id": "LB-3484189636AE", "smiles": "CC(C)(C)c1ccc(NC(=O)Nc2c[nH]c3ccc(F)cc23)cc1"}, {"compound_id": "LB-E7BF2FCBEFA6", "smiles": "O=C(Nc1ccc(C2CCC(F)(F)CC2)cc1)Nc1c[nH]c2ccc(F)cc12"}, {"compound_id": "LB-3B57488278D4", "smiles": "O=C(Nc1ccc(C(F)(F)F)cc1)Nc1c[nH]c2ccc(F)cc12"}, {"compound_id": "LB-A8BE1CB9EBE9", "smiles": 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