diff --git "a/data/nav17_test.json" "b/data/nav17_test.json"
new file mode 100644--- /dev/null
+++ "b/data/nav17_test.json"
@@ -0,0 +1 @@
+{"board": "Nav17", "n": 1314, "source": "ChEMBL_37 (EMBL-EBI)", "source_url": "https://www.ebi.ac.uk/chembl/", "license": "CC BY-SA 3.0 Unported", "license_url": "https://creativecommons.org/licenses/by-sa/3.0/", "attribution": "Derived from ChEMBL (EMBL-EBI), licensed CC BY-SA 3.0. Redistribution must retain attribution and the same license.", "note": "구조만 포함한다. 라벨은 배포하지 않는다.", "compounds": [{"compound_id": "LB-289A4A2A8F8E", "smiles": "O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(Cl)ccc1O"}, {"compound_id": "LB-F48930C1BD1E", "smiles": "O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1O"}, {"compound_id": "LB-62F09759BEAF", "smiles": "O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(Cl)c1O"}, {"compound_id": "LB-15EB4C231B71", "smiles": "O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(Cl)cc1O"}, {"compound_id": "LB-EFCC4E92F145", "smiles": "O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(F)c1O"}, {"compound_id": "LB-DA4EE00B0FD2", "smiles": "O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc2ccccc2c1O"}, {"compound_id": "LB-4F3A71B42522", "smiles": "O=C(Nc1cccc(C(F)(F)F)c1)c1cc(Cl)ccc1O"}, {"compound_id": "LB-0E1A6F87386D", "smiles": "O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Cl)ccc1O"}, {"compound_id": "LB-9935CF138577", "smiles": "O=C(Nc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc(Cl)ccc1O"}, {"compound_id": "LB-5923F38CAA39", "smiles": "O=C(Nc1cc(Cl)cc(Cl)c1)c1cc(Cl)ccc1O"}, {"compound_id": "LB-40A50746F0E5", "smiles": "O=C(Nc1cc(F)cc(F)c1)c1cc(Cl)ccc1O"}, {"compound_id": "LB-8667D8AAB1A3", "smiles": "O=C(Nc1cccc(Cl)c1)c1cc(Cl)ccc1O"}, {"compound_id": "LB-6E59BD33E05A", "smiles": "O=C(NCc1cccc(C(F)(F)F)c1Cl)[C@@H]1CCC(=O)N1c1cccs1"}, {"compound_id": "LB-5C0D8837043E", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1c1cscn1"}, {"compound_id": "LB-8A5B4CE3F594", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1c1nccs1"}, {"compound_id": "LB-CF9D9D80A909", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1c1ccoc1"}, {"compound_id": "LB-AA2BFE4BDCD2", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1c1ccco1"}, {"compound_id": "LB-0D61C9ACC418", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1c1ccsc1"}, {"compound_id": "LB-630A25464D39", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1c1cccs1"}, {"compound_id": "LB-DACBA1CE4682", "smiles": "CN1C(=O)CC[C@H]1C(=O)NCc1ccc(Cl)cc1Cl"}, {"compound_id": "LB-C6EF053BF5DE", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)C1CC(=O)N(c2cccs2)C1"}, {"compound_id": "LB-9D3A05282A3C", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1COC(=O)N1c1cccs1"}, {"compound_id": "LB-4CEEDC13262A", "smiles": "CN1CCN(/C=C2\\C[C@@H](C(=O)NCc3ccc(Cl)cc3Cl)N(c3cccs3)C2=O)CC1"}, {"compound_id": "LB-C54C5D8BB198", "smiles": "O=C1N[C@H](C(=O)NCc2ccc(Cl)cc2Cl)C/C1=C\\N1CCOCC1"}, {"compound_id": "LB-0C6CE0E14A5D", "smiles": "COC(=O)[C@@H]1C/C(=C\\NCc2ccc(Cl)cc2Cl)C(=O)N1C(=O)OC"}, {"compound_id": "LB-43F42382C334", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1C/C(=N\\O)C(=O)N1c1cccs1"}, {"compound_id": "LB-D347959CBB6E", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1Cc1ccccc1Cl"}, {"compound_id": "LB-DD67231CAD8B", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1Cc1ccccc1"}, {"compound_id": "LB-0F70F2822F0A", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CCC(=O)N1c1ccccc1"}, {"compound_id": "LB-506C89057A90", "smiles": "O=C(Cn1cnc2c(Cl)ncnc21)c1ccc(Cl)cc1Cl"}, {"compound_id": "LB-CA7F9299E27F", "smiles": "O=C(Cn1cnc2c(Cl)ncnc21)c1ccc(Cl)cc1"}, {"compound_id": "LB-4DE68CE5E20D", "smiles": "O=C(Cn1cnc2c(-c3ccccc3)ncnc21)c1ccc(Cl)cc1Cl"}, {"compound_id": "LB-67088F41E1C5", "smiles": "O=C(Cn1cnc2c(Cl)nc(Cl)nc21)c1ccc(Cl)cc1Cl"}, {"compound_id": "LB-2CAF26D5FC63", "smiles": "O=S(=O)(c1ccccc1Cl)n1cnc2c(Cl)nc(Cl)nc21"}, {"compound_id": "LB-63401218A4B6", "smiles": "Cn1c(=O)c2c(ncn2S(=O)(=O)c2ccccc2Cl)n(C)c1=O"}, {"compound_id": "LB-AB5E5F648207", "smiles": "CCCN1CCN(C(=O)c2ccccc2Cl)C(c2ccccc2)C1"}, {"compound_id": "LB-2D1EBBF7C5E5", "smiles": "CN1CCN(C(=O)c2ccccc2Cl)CC1c1ccccc1"}, {"compound_id": "LB-B23669042FC5", "smiles": "CCN1CCN(C(=O)c2ccccc2Cl)CC1c1ccccc1"}, {"compound_id": "LB-2FF815C1EC7A", "smiles": "O=C(c1cccc(Cl)c1Cl)N1CCN(CCC(F)(F)F)C(c2ccccc2)C1"}, {"compound_id": "LB-BF9D24E2C76F", "smiles": "O=C(Nc1ccccc1Cl)N1CCN(C(=O)Nc2ccccc2Cl)C(c2ccccc2)C1"}, {"compound_id": "LB-A65EF697959B", "smiles": "COc1ccc(C(=O)N2CCN(c3c(Nc4ccccc4C)c(=O)c3=O)CC2c2ccccc2)cc1OC"}, {"compound_id": "LB-2E914C65061F", "smiles": "COc1ccc(C(=O)N2CCN(c3c(Nc4cccc5ncccc45)c(=O)c3=O)CC2c2ccccc2)cc1OC"}, {"compound_id": "LB-AC6CD4DEC655", "smiles": "COc1ccc(NC(=O)N2CCN(c3c(Nc4ccccc4C)c(=O)c3=O)CC2c2ccccc2)cc1OC"}, {"compound_id": "LB-A5D54B6CBE2C", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccc(Cl)cc3)C(c3ccccc3)C2)c(=O)c1=O"}, {"compound_id": "LB-1400BD28E49D", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccccc3Cl)C(c3ccccc3)C2)c(=O)c1=O"}, {"compound_id": "LB-430353A70944", "smiles": "COc1ccc(NC(=O)N2CCN(c3c(Nc4ccccc4C)c(=O)c3=O)CC2)cc1OC"}, {"compound_id": "LB-C7A7C04AAAF0", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccc(N)cc3)CC2)c(=O)c1=O"}, {"compound_id": "LB-DE437CD229C6", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccc(F)cc3)CC2)c(=O)c1=O"}, {"compound_id": "LB-A9DD58DFA785", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccc(Cl)cc3)CC2)c(=O)c1=O"}, {"compound_id": "LB-794E2DE8A0D6", "smiles": "Cc1ccc(NC(=O)N2CCN(c3c(Nc4ccccc4C)c(=O)c3=O)CC2)cc1"}, {"compound_id": "LB-0BD1979BA310", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccccc3)CC2)c(=O)c1=O"}, {"compound_id": "LB-8D88459A82E4", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccc(C(C)(C)C)cc3)CC2)c(=O)c1=O"}, {"compound_id": "LB-BFE76AFA2646", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)c(=O)c1=O"}, {"compound_id": "LB-4A4D9C92FCB5", "smiles": "COC(=O)c1ccc(NC(=O)N2CCN(c3c(Nc4ccccc4C)c(=O)c3=O)CC2)cc1"}, {"compound_id": "LB-086FD498A0A9", "smiles": "Cc1ccccc1Nc1c(N2CCN(C(=O)NC3CCCCC3)CC2)c(=O)c1=O"}, {"compound_id": "LB-0A48E688C4A2", "smiles": "CC(C)(C)c1ccc(NC(=O)N2CCN(c3c(Nc4cccc5ncccc45)c(=O)c3=O)CC2)cc1"}, {"compound_id": "LB-73D8CE5D69DC", "smiles": "O=C(NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)c1sc(-c2ncccn2)nc1C(F)(F)F"}, {"compound_id": "LB-B5A4770D13AB", "smiles": "O=C(NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1sc(-c2ncccn2)nc1C(F)(F)F"}, {"compound_id": "LB-2DCAFDE522C4", "smiles": "O=C(NCC1CCCCCC1)c1cn(CCO)c2ccccc12"}, {"compound_id": "LB-4F848B83719F", "smiles": "Cc1cccc2sc(NC(=O)CCN3CCN(CCN(C)C)CC3)nc12"}, {"compound_id": "LB-873962D3B922", "smiles": "Cc1cccc2sc(NC(=O)CCN3CCN(CCCN(C)C)CC3)nc12"}, {"compound_id": "LB-AEE10BD07C66", "smiles": "Cc1cccc2sc(NC(=O)CCN3CCN(c4ccccn4)CC3)nc12"}, {"compound_id": "LB-E03305AAFE7C", "smiles": "Cc1cccc2sc(NC(=O)CCN3CCN(c4ccncc4)CC3)nc12"}, {"compound_id": "LB-BCF9B1172ABB", "smiles": "Cc1cccc2sc(NC(=O)CCN3CCN(c4ncccn4)CC3)nc12"}, {"compound_id": "LB-2D25808A45DE", "smiles": "O=C(NC(=S)Nc1ccccc1O)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-BCCE9AD5163B", "smiles": "O=C(NC(=S)Nc1ccc(O)cc1)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-4A0FC4C9E563", "smiles": "O=C(NC(=S)Nc1cc(Cl)c(O)c(Cl)c1)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-5632B60C7A28", "smiles": "O=C(NC(=S)Nc1cc(Br)cc(C(F)(F)F)c1)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-C571CC1CBEDA", "smiles": "NS(=O)(=O)c1ccccc1NC(=S)NC(=O)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-088CC8F36329", "smiles": "O=C(NC(=S)Nc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-3A7B663529B7", "smiles": "COc1ccc(NC(=S)NC(=O)C23CC4CC(CC(C4)C2)C3)cc1OC"}, {"compound_id": "LB-8341A97D863B", "smiles": "O=C(NC(=S)Nc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-6F7B84C7261D", "smiles": "Cc1ccc(NC(=S)NC(=O)C23CC4CC(CC(C4)C2)C3)c(Br)c1"}, {"compound_id": "LB-9B7C0094E088", "smiles": "O=C(NC(=S)Nc1cccnc1Cl)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-2EA49818ECEF", "smiles": "Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)cc1NC(=O)c1cccc(NC(=O)Nc2cccc(C(=O)Nc3cc(C(=O)Nc4ccc(S(=O)(=O)O)c5cc(S(=O)(=O)O)cc(S(=O)(=O)O)c45)ccc3C)c2)c1"}, {"compound_id": "LB-11D95FCD9BF7", "smiles": "Nc1c(S(=O)(=O)O)cc(Nc2ccc(Nc3nc(Cl)nc(Nc4cccc(S(=O)O)c4)n3)c(S(=O)(=O)O)c2)c2c1C(=O)c1ccccc1C2=O"}, {"compound_id": "LB-0412A3E11F72", "smiles": "O=C(NC(=S)Nc1cccc2cccnc12)C12CC3CC(CC(C3)C1)C2"}, {"compound_id": "LB-55F165663C0C", "smiles": "CC(C)c1ccc(NC(=S)NC(=O)C23CC4CC(CC(C4)C2)C3)c(Br)c1"}, {"compound_id": "LB-21363283E828", "smiles": "O=C(NC(=S)Nc1ccc(O)cc1)c1ccc2c(c1)OCO2"}, {"compound_id": "LB-A0107D088439", "smiles": "NS(=O)(=O)c1cccc(NC(=S)NC(=O)c2ccc3c(c2)OCO3)c1"}, {"compound_id": "LB-4CE3D9E05F8D", "smiles": "NS(=O)(=O)c1ccc(CCNC(=S)NC(=O)c2ccc3c(c2)OCO3)cc1"}, {"compound_id": "LB-F0C4EACD6EBD", "smiles": "O=C(NC(=S)Nc1cc(Br)cc(C(F)(F)F)c1)c1ccc2c(c1)OCO2"}, {"compound_id": "LB-A80919864AA2", "smiles": "O=C(NC(=S)Nc1c(Br)ccc(C(F)(F)F)c1Br)c1ccc2c(c1)OCO2"}, {"compound_id": "LB-BF86EB19F5CE", "smiles": "O=C(NC(=S)Nc1cc(Cl)c(O)c(Cl)c1)c1ccc2c(c1)OCO2"}, {"compound_id": "LB-F4812EDDCFFE", "smiles": "O=C(NC(=S)Nc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2"}, {"compound_id": "LB-F1A0D70CB87C", "smiles": "CC(C)c1ccc(NC(=S)NC(=O)c2ccc3c(c2)OCO3)c(Br)c1"}, {"compound_id": "LB-728814408694", "smiles": "O=C(NC(=S)Nc1cccnc1Cl)c1ccc2c(c1)OCO2"}, {"compound_id": "LB-6906C99502FD", "smiles": "O=C(NC(=S)Nc1cccc2cccnc12)c1ccc2c(c1)OCO2"}, {"compound_id": "LB-971D214C7973", "smiles": "C[C@@H]1Cn2c(nnc2-c2cc(O[11CH3])ccn2)CN1C(=O)c1cccc(Cl)c1Cl"}, {"compound_id": "LB-8D8BAFF5AAE1", "smiles": "C[C@H]1Cc2c(nnn2-c2ncccn2)CN1C(=O)c1ccnc(C(F)(F)F)c1[18F]"}, {"compound_id": "LB-D0311D15410A", "smiles": "COc1ccc(CC(=O)NC(N/C(=N/C#N)Nc2cccc3ncccc23)C(C)(C)C)cc1O[11CH3]"}, {"compound_id": "LB-466B3EE0E2DC", "smiles": "[11CH3]N1C(=O)CC[C@H]1C(=O)NCc1cccc(C(F)(F)F)c1Cl"}, {"compound_id": "LB-DB4A80865211", "smiles": "O=C(NCc1cccc(C(F)(F)F)c1Cl)[C@@H]1CCC(=O)N1CC[18F]"}, {"compound_id": "LB-66871C7C5DC1", "smiles": "[11CH3]Oc1ccc(Cl)c(C(=O)NCC23CC4(F)CC(F)(CC(F)(C4)C2)C3)c1"}, {"compound_id": "LB-41CB37461735", "smiles": "O=c1[nH]c2ccccc2n1CCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-4A2C589F6A11", "smiles": "O=C(C(c1ccccc1)c1ccccc1)N1CCN(CCCn2c(=O)[nH]c3ccccc32)CC1"}, {"compound_id": "LB-1F9236499B39", "smiles": "O=c1[nH]c2ccccc2n1CCCN1CCN(C2c3ccccc3CCc3ccccc32)CC1"}, {"compound_id": "LB-AC1FE09FB858", "smiles": "O=c1[nH]c2ccccc2n1CCCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-073AE42C0A21", "smiles": "O=c1[nH]c2ccccc2n1CCCN1CCC(=C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-F50591328218", "smiles": "O=c1[nH]c2ccccc2n1CCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-65699216C5EA", "smiles": "O=c1[nH]c2ccccc2n1CCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-E2891B43C54D", "smiles": "O=c1[nH]c2ccccc2n1CCCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-53CA7EB9D735", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3cnc4ccccc43)CC2)cc1"}, {"compound_id": "LB-3124B5CBEEB2", "smiles": "Cc1nc2ccccc2n1CCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-43DFBE5CB892", "smiles": "c1ccc(-c2nc3ccccc3n2CCCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1"}, {"compound_id": "LB-C18E3088A1C5", "smiles": "Cc1cc2ncn(CCCCN3CCN(C(c4ccccc4)c4ccccc4)CC3)c2cc1C"}, {"compound_id": "LB-17016B6BF5BB", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3ncc4ccccc43)CC2)cc1"}, {"compound_id": "LB-C49E2920E63C", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3ccc4ncccc43)CC2)cc1"}, {"compound_id": "LB-6319857AE4EF", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3ccc4cnccc43)CC2)cc1"}, {"compound_id": "LB-4DD599C695A5", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3ccc4ccncc43)CC2)cc1"}, {"compound_id": "LB-B3259E6F4733", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3ccc4cccnc43)CC2)cc1"}, {"compound_id": "LB-37EB9EDA756B", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3nnc4ccccc43)CC2)cc1"}, {"compound_id": "LB-9D7F40B95569", "smiles": "c1ccc(C(c2ccccc2)N2CCN(CCCCn3ccc4ccccc43)CC2)cc1"}, {"compound_id": "LB-FCC6618A697E", "smiles": "Cc1nnnn1CCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-725E94B5B62B", "smiles": "c1ccc(-c2nnnn2CCCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1"}, {"compound_id": "LB-1A5725D45DDF", "smiles": "Cc1nccn1CCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-EAB1857D7BE3", "smiles": "Cc1cccc2c1ccn2CCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-650A73DAF513", "smiles": "Cc1ccc2ccn(CCCCN3CCN(C(c4ccccc4)c4ccccc4)CC3)c2c1"}, {"compound_id": "LB-31E9A62643B2", "smiles": "Cc1cccc2ccn(CCCCN3CCN(C(c4ccccc4)c4ccccc4)CC3)c12"}, {"compound_id": "LB-F7297FF3531F", "smiles": "N#Cc1cn(CCCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)c2ccccc12"}, {"compound_id": "LB-065427202142", "smiles": "N#Cc1ccc2c(ccn2CCCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)c1"}, {"compound_id": "LB-72F97BDB145F", "smiles": "Fc1cccc2c1ccn2CCCCN1CCN(C(c2ccccc2)c2ccccc2)CC1"}, {"compound_id": "LB-DEBEC6BEE969", "smiles": "Fc1ccc2c(ccn2CCCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)c1"}, {"compound_id": "LB-F89514C0FAE5", "smiles": "Fc1ccc2ccn(CCCCN3CCN(C(c4ccccc4)c4ccccc4)CC3)c2c1"}, {"compound_id": "LB-238A7A1EFD63", "smiles": "Fc1cc2ccn(CCCCN3CCN(C(c4ccccc4)c4ccccc4)CC3)c2cc1F"}, {"compound_id": "LB-F10B8C95057C", "smiles": "C[C@@H](CO)n1ccc2c(NC(=O)CC34CC5CC(CC(C5)C3)C4)cccc2c1=O"}, {"compound_id": "LB-FCB94D196328", "smiles": "C[C@H](CO)n1ccc2c(NC(=O)CC34CC5CC(CC(C5)C3)C4)cccc2c1=O"}, {"compound_id": "LB-ADDBBC03F4D3", "smiles": "COc1ccc(Cl)c(C(=O)NCC23CC4(F)CC(F)(CC(F)(C4)C2)C3)c1"}, {"compound_id": "LB-82BD8B50241B", "smiles": "COc1ccc(Cl)c(C(=O)NCC23CC4CC(CC(C4)C2)C3)c1"}, {"compound_id": "LB-D578EF8143A3", "smiles": "COc1ccc(Cl)c(C(=O)NCC23CC4CC(CC(F)(C4)C2)C3)c1"}, {"compound_id": "LB-9582425FCBD3", "smiles": "COc1ccc(Cl)c(C(=O)NCC23CC4CC(F)(CC(F)(C4)C2)C3)c1"}, {"compound_id": "LB-754705A0E395", "smiles": "O=C(NCc1cccc(C(F)(F)F)c1Cl)[C@@]1(O)CCC(O)c2ncccc21"}, {"compound_id": "LB-9F6628C05C6A", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(OCc2cccc(F)c2)CC1"}, {"compound_id": "LB-49EAC1558AFD", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(OCc2ccccc2F)CC1"}, {"compound_id": "LB-3D5BC5A8891A", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(OCc2ccc(F)cc2)CC1"}, {"compound_id": "LB-70EF563095C2", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(OCc2cc(F)cc(F)c2)CC1"}, {"compound_id": "LB-2E2008FD7100", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(Oc2ccc(F)c(F)c2)CC1"}, {"compound_id": "LB-1558E4267F22", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2ccccc2F)CC1)c1cccc2ncccc12"}, {"compound_id": "LB-889CE1B36836", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(Oc2ccccc2F)CC1"}, {"compound_id": "LB-571284DFCC9A", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2cccnc2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-603F5DBD492E", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2cncc(F)c2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-25B5EDAC981C", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2cccc(F)n2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-4C3359C853CF", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2cccc(Cl)n2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-3D4E97157AE5", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2cccnn2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-1724B6031773", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2cnccn2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-62C80EC0D5CB", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2nccs2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-397A84F582C0", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2nc(Cl)cs2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-C55DD73C8BEC", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2nc3ccccc3s2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-A305788D3E95", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2nccc3ncccc23)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-CF6A380FC6F0", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2nccn3nccc23)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-3304811F8E9E", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2nccn3cnnc23)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-53EF36679016", "smiles": "COc1ccc(C)c(Nc2nc(=O)cnn2Cc2cncc(F)c2)c1"}, {"compound_id": "LB-FA4AF69FF26C", "smiles": "Cc1ccc(CO)cc1Nc1nc(=O)ccn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-7D2EF1D374E0", "smiles": "Cc1c(F)cc(CO)cc1Nc1nc(=O)cnn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-69C520AF569D", "smiles": "Cc1ccc(-c2ncco2)cc1Nc1nc(=O)cnn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-0136A11A4C3C", "smiles": "Cc1ccc(N2CCCC2=O)cc1Nc1nc(=O)cnn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-424B1A5F4CE3", "smiles": "Cc1ccc(OCCO)cc1Nc1nc(=O)cnn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-5F6826935533", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)c4[nH]cnc4n3Cc3ccc(F)cc3)cc2s1"}, {"compound_id": "LB-DDF843FB94A1", "smiles": "Cc1ccc(Cn2c(Nc3cc4sc(C)nc4cc3C)nc(=O)c3[nH]cnc32)cc1"}, {"compound_id": "LB-C5AE5802EAD1", "smiles": "COc1cnc(C)c(Nc2nc(=O)c3c(n2Cc2cc(F)c(F)c(F)c2)CCC3)c1"}, {"compound_id": "LB-E6611A01AFF9", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)cc2n1C(c1ccccc1)COC2"}, {"compound_id": "LB-70D207D77228", "smiles": "COc1ccc(Cc2noc(=O)n2CC2CCC(F)(F)CC2)cc1"}, {"compound_id": "LB-F21E3B50E5F4", "smiles": "Cc1ncccc1Cc1noc(=O)n1CC1CCC(F)(F)CC1"}, {"compound_id": "LB-7BBF0CBC86C6", "smiles": "CC1=C(Cn2cc(COCc3ccco3)nn2)C(=O)c2ccccc2C1=O"}, {"compound_id": "LB-453568885981", "smiles": "CC1=C(C(c2ccccc2)n2cc(COCc3ccco3)nn2)C(=O)c2ccccc2C1=O"}, {"compound_id": "LB-EB1488C4316F", "smiles": "CC1=C(C(c2ccc([N+](=O)[O-])cc2)n2cc(COCc3ccco3)nn2)C(=O)c2ccccc2C1=O"}, {"compound_id": "LB-CCB7874B9D18", "smiles": "CC1=C(C(c2ccc(Cl)cc2)n2cc(COCc3ccco3)nn2)C(=O)c2ccccc2C1=O"}, {"compound_id": "LB-716538561B94", "smiles": "Cc1ccc2c(=O)n(C(C)CO)ccc2c1NC(=O)Cc1ccc(C(F)(F)F)c(F)c1"}, {"compound_id": "LB-1F60899494E7", "smiles": "CS(=O)(=O)Nc1cccc(-c2ccc(Cl)c(C(=O)NCc3cn(-c4cc(Cl)ccn4)nn3)c2)c1"}, {"compound_id": "LB-ABF58533E9D0", "smiles": "COc1ccc(-c2ccc(Cl)c(C(=O)NCc3cn(-c4cc(Cl)ccn4)nn3)c2)cc1OC"}, {"compound_id": "LB-F21F04CE0A3E", "smiles": "CS(=O)(=O)c1ccc(-c2ncc(C(=O)NCc3cn(-c4cc(Cl)ccn4)nn3)s2)cc1"}, {"compound_id": "LB-EBAFBAE2038E", "smiles": "CS(=O)(=O)Nc1ccc(-c2ncc(C(=O)NCc3cn(-c4cc(Cl)ccn4)nn3)s2)cc1"}, {"compound_id": "LB-7CFE51133C31", "smiles": "Nc1cccc(-c2ncc(C(=O)NCc3cn(-c4cc(Cl)ccn4)nn3)s2)c1"}, {"compound_id": "LB-38D83ED1A8AD", "smiles": "O=C(NCc1cn(-c2cc(Cl)ccn2)nn1)c1cnc(-c2cccc(NS(=O)(=O)N3CCOCC3)c2)s1"}, {"compound_id": "LB-BD91D7362FD9", "smiles": "O=C(NCc1cn(-c2cc(Cl)ccn2)nn1)c1cnc(-c2cccc(NS(=O)(=O)C3CC3)c2)s1"}, {"compound_id": "LB-6FCE5373A142", "smiles": "O=C(NCc1cn(-c2cc(Cl)ccn2)nn1)c1cnc(-c2ccc(NS(=O)(=O)N3CCOCC3)cc2)s1"}, {"compound_id": "LB-4A30489B012B", "smiles": "CC(C)S(=O)(=O)c1ccc(-c2ncc(C(=O)NCc3cn(-c4cc(Cl)ccn4)nn3)s2)cc1"}, {"compound_id": "LB-841BFB85F390", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4cc(Cl)ccn4)nn3)cs2)cc1"}, {"compound_id": "LB-1891CB36D82E", "smiles": "CS(=O)(=O)c1ccc(-c2ncc(C(=O)NCc3cn(-c4cc(Br)ccn4)nn3)s2)cc1"}, {"compound_id": "LB-459438A83D7B", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4cc(Br)ccn4)nn3)cs2)cc1"}, {"compound_id": "LB-B2B4B36B09FE", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4ccc(Br)cn4)nn3)cs2)cc1"}, {"compound_id": "LB-C6344FBF5F1A", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4cccc(Br)n4)nn3)cs2)cc1"}, {"compound_id": "LB-DF6177B5266C", "smiles": "O=C1C=C(n2cc(CCCl)nn2)C(=O)c2c(O)cccc21"}, {"compound_id": "LB-12609ECD9BC7", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)C1CCC(=O)N1c1ccoc1"}, {"compound_id": "LB-06C52638CB5A", "smiles": "Cl.Cl.O=C(CC12CC3CC(CC(C3)C1)C2)Nc1cccc2nc(NCCNCCO)ccc12"}, {"compound_id": "LB-D4FB7B5B2712", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(Oc2ccc(F)cc2)CC1"}, {"compound_id": "LB-97055CCC619D", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(Oc2cccc(F)c2)CC1"}, {"compound_id": "LB-29B8C5072F6D", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(Oc2ccccc2F)CC1"}, {"compound_id": "LB-623791F62FE4", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(Oc2cc(F)cc(F)c2)CC1"}, {"compound_id": "LB-32398B0B5DCB", "smiles": "Cc1ncsc1C(CNC(=O)c1c(F)cccc1Cl)N1CCC(Oc2ccc(F)c(F)c2)CC1"}, {"compound_id": "LB-C04E57EA4EA1", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(OCc2ccc(F)cc2)CC1"}, {"compound_id": "LB-A57918F02072", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(OCc2cccc(F)c2)CC1"}, {"compound_id": "LB-465FCFE4DA40", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(OCc2cc(F)cc(F)c2)CC1"}, {"compound_id": "LB-4FFA053BB3B0", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(OCc2ccc(F)c(F)c2)CC1"}, {"compound_id": "LB-7D18DC9351CB", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(Oc2ccc(F)cc2)CC1"}, {"compound_id": "LB-CF235EBDB9F8", "smiles": "Cc1ncsc1C(CNC(=O)c1cccc2ncccc12)N1CCC(Oc2cccc(F)c2)CC1"}, {"compound_id": "LB-7480E237218E", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2cccc(F)c2)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-6933AC19DA0D", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2ccccc2F)CC1)c1c(F)cccc1Cl"}, {"compound_id": "LB-170A1CB81A73", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(OCc2ccc(F)c(F)c2)CC1)c1cccc2ncccc12"}, {"compound_id": "LB-EE1EC5FB0076", "smiles": "O=C(NCC(c1scnc1C(F)F)N1CCC(Oc2ccc(F)cc2)CC1)c1cccc2ncccc12"}, {"compound_id": "LB-6AD8D3E7BE85", "smiles": "Cc1c(C(=O)N2Cc3nnn(C4=NN=CC4)c3CC2C)cccc1C(F)(F)F"}, {"compound_id": "LB-BE1B451991AE", "smiles": "C[C@H]1CC2=C(CN1C(=O)c1cccc(C(F)(F)F)c1)NNN2c1ncc(F)cn1"}, {"compound_id": "LB-042F46802F10", "smiles": "COCCn1cc(C(=O)NC(CO)c2cccc(C(F)(F)F)c2Cl)c2c(Cl)cccc21"}, {"compound_id": "LB-1A82F6FA133E", "smiles": "COCCn1cc(C(=O)NCC2(c3ccc(C(F)(F)F)cc3)CCOCC2)c2c(Cl)cccc21"}, {"compound_id": "LB-EB13E1EF0B45", "smiles": "CC(NC(=O)c1cn(C2COC2)c2cccc(Cl)c12)C12CC3CC(CC(O)(C3)C1)C2"}, {"compound_id": "LB-BA1895581CAB", "smiles": "O=C(NCC1CCCC(C(F)(F)F)C1)c1cn(C2CCOC2)c2cccc(Cl)c12"}, {"compound_id": "LB-9E05619221FA", "smiles": "O=C(NCC1CCC(F)(F)CC1)c1cn(CC2(O)CC2)c2cccc(Cl)c12"}, {"compound_id": "LB-A0A3CFCCBDC0", "smiles": "CN1CC(n2cc(C(=O)NCC3(O)CCC(F)(F)CC3)c3c(Cl)cccc32)C1"}, {"compound_id": "LB-BF04FB04D40E", "smiles": "CN1CC(n2cc(C(=O)NCC3CCC(F)(F)CC3)c3c(Cl)cccc32)C1"}, {"compound_id": "LB-1AB495CB197B", "smiles": "O=C(NCC1CCC(F)(F)CC1)c1cn(C2CCNC2)c2cccc(Cl)c12"}, {"compound_id": "LB-0739A4E90FE4", "smiles": "O=C(NCC1CCC(F)(F)CC1)c1cn(C[C@@H]2CCN2)c2cccc(Cl)c12"}, {"compound_id": "LB-777D8D8E03C3", "smiles": "O=C(NCC1CCC(F)(F)CC1)c1cn(CC2CCOC2)c2cccc(Cl)c12"}, {"compound_id": "LB-D0FF5A5ACBC7", "smiles": "O=C(NCC1CCC(F)(F)CC1)c1cn(CC2COCCN2)c2cccc(Cl)c12"}, {"compound_id": "LB-367597DA1E2C", "smiles": "O=C(NCC1(O)CCC(F)(F)CC1)c1cn(CC2COCCN2)c2cccc(Cl)c12"}, {"compound_id": "LB-0DB8FCE9909F", "smiles": "CN1CCC[C@H]1Cn1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c2c(Cl)cccc21"}, {"compound_id": "LB-262E395ADC2E", "smiles": "O=C(NCC1CCC(F)(F)CC1)c1cn(C2CC3(CNC3)C2)c2cccc(Cl)c12"}, {"compound_id": "LB-4CBDCEBD56BC", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-B92569BE4642", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-FD87B44506B3", "smiles": "COc1cn(CCc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-42E746B9099A", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C#N)cn1Cc1ccccc1"}, {"compound_id": "LB-E7AB050BD7C2", "smiles": "COc1cn(Cc2ccccc2C)c(Nc2cccc(C(F)(F)F)c2Cl)nc1=O"}, {"compound_id": "LB-84CEA0DEDFFD", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(=O)NC2CCOCC2)cn1Cc1ccccc1"}, {"compound_id": "LB-FC98D3437924", "smiles": "COC(=O)Nc1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-99ABB76119AC", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(N)cn1Cc1ccccc1"}, {"compound_id": "LB-4C6C1DD872D0", "smiles": "Cc1nc2cc(C)c(Nc3cc(=O)n(C)c(=O)n3Cc3cc(F)c(F)c(F)c3)cc2s1"}, {"compound_id": "LB-EE296488DE98", "smiles": "COc1cn(Cc2ccccc2)c(NC2C[C@@H]3CC[C@H]2C3)nc1=O"}, {"compound_id": "LB-6BC973083265", "smiles": "COc1cccc(Cn2cc(OC)c(=O)nc2Nc2cccc(Cl)c2C)c1"}, {"compound_id": "LB-B93F79C27B93", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)ccn1CCc1ccccc1"}, {"compound_id": "LB-BF521731FCED", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3c2CCC3)nc1=O"}, {"compound_id": "LB-AFD92FE88980", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3sccc23)nc1=O"}, {"compound_id": "LB-9C6FBF966E91", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3c2CCO3)nc1=O"}, {"compound_id": "LB-FF7D0F788404", "smiles": "COc1cn(Cc2ccccc2)c(NCc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-4CB87BB16B52", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(OCc2ccccc2)cn1Cc1ccccc1"}, {"compound_id": "LB-6BA65C2995EB", "smiles": "COc1cn(Cc2ccccc2F)c(Nc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-4F780C0F3F59", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1F)CCC2"}, {"compound_id": "LB-941C065D947F", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cncc(Cl)c2C)nc1=O"}, {"compound_id": "LB-AAF19E8BB03D", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)cc1)CCC2"}, {"compound_id": "LB-AC9ACFD392C3", "smiles": "COc1cn(Cc2ccccc2)c(NC2CCc3ccccc3C2)nc1=O"}, {"compound_id": "LB-7F6EE6F60FBE", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3c2CCCC3)nc1=O"}, {"compound_id": "LB-CD59E0D9B4DD", "smiles": "COc1cn(Cc2ccc(Cl)cc2)c(Nc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-E024E7A47AAD", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccc(Cl)cc1)CCC2"}, {"compound_id": "LB-87EEC599D6A3", "smiles": "CCOC(=O)c1cn(Cc2ccccc2)c(Nc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-B3BF97E02A94", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(O)cn1Cc1ccccc1"}, {"compound_id": "LB-90FE408D41D9", "smiles": "Cc1cc(C)c(Nc2nc(=O)c(C(=O)O)cn2Cc2ccccc2)cc1C"}, {"compound_id": "LB-D50C5AD6F39C", "smiles": "Cc1ccc(N2CCCS2(=O)=O)cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)cc1"}, {"compound_id": "LB-04A4FFE2DC29", "smiles": "Cc1cc(C)c(Nc2nc(=O)c(C(N)=O)cn2Cc2ccccc2)cc1C"}, {"compound_id": "LB-0DF0326FB273", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1)CCC2"}, {"compound_id": "LB-E0FEED4E73D0", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-0F4BCDEC7420", "smiles": "COc1cn(Cc2ccccc2C(F)(F)F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-8FD4733EC9C5", "smiles": "COc1cn(Cc2cccc(C(F)(F)F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-45AD9952AD4C", "smiles": "COc1cn(Cc2ccc(C(F)(F)F)cc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-1D2BA1CDBD9F", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(N[C@@H]2CCc3ccccc32)nc1=O"}, {"compound_id": "LB-6E35E5845F0F", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(N[C@@H]2CCCc3ccccc32)nc1=O"}, {"compound_id": "LB-593714EBDF33", "smiles": "COc1cn(Cc2cc(F)c(F)cc2F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-4032FB4F2C2E", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1"}, {"compound_id": "LB-C6B6E8AD9F19", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-5F1C231FE8B2", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-D5D2981257AC", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(F)cn1Cc1ccccc1)OCCO2"}, {"compound_id": "LB-B96C5DDDED0D", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)cc1)OCCO2"}, {"compound_id": "LB-A0DFD02C0F2E", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(Cl)cn1Cc1ccccc1)OCCO2"}, {"compound_id": "LB-81211AF89800", "smiles": "COc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)cc1C"}, {"compound_id": "LB-519BC1522AFC", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccccc2SC)nc1=O"}, {"compound_id": "LB-DEA2CC5CBAA0", "smiles": "CCOc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)cc1C"}, {"compound_id": "LB-D4AA0CB52C25", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cccc3[nH]c(=O)ccc23)nc1=O"}, {"compound_id": "LB-45060DFF10DC", "smiles": "COc1cc(C)cc(Nc2nc(=O)c(OC)cn2Cc2cccc(F)c2)c1C"}, {"compound_id": "LB-27AE547B62C2", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(F)c2)c1"}, {"compound_id": "LB-1E78FD73DA1E", "smiles": "COc1cn(Cc2cc(C)cc(F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-28EE12E7902F", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(C)c(F)cc2C)nc1=O"}, {"compound_id": "LB-DF6864B13ACE", "smiles": "COc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)cc1OC"}, {"compound_id": "LB-C27EC0565B18", "smiles": "CCc1ccccc1CNc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-E6A131F853DA", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cccc(OC(F)F)c2C)nc1=O"}, {"compound_id": "LB-9587C32D1DBF", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc3[nH]c(C)cc23)nc1=O"}, {"compound_id": "LB-63804E8F39AD", "smiles": "COc1cn(Cc2ccc(F)c(C)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-529A44E2AE6B", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc(SC)c2C)nc1=O"}, {"compound_id": "LB-58D23AED3FCB", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-FB5CBB01E397", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3[nH]ncc3cc2C)nc1=O"}, {"compound_id": "LB-0818E066E011", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3[nH]ccc3cc2C)nc1=O"}, {"compound_id": "LB-235D91AC617E", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cccc3sccc23)nc1=O"}, {"compound_id": "LB-6D7D1917B37D", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cccc3occc23)nc1=O"}, {"compound_id": "LB-D8E3E10D4228", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc3c(=O)[nH]ccc23)nc1=O"}, {"compound_id": "LB-15C1450A6CDE", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc3sccc23)nc1=O"}, {"compound_id": "LB-D3902FB42238", "smiles": "COc1ccccc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(F)c1"}, {"compound_id": "LB-93D040CD6AD3", "smiles": "COc1cc(Cn2cc(OC)c(=O)nc2Nc2cccc(Cl)c2C)ccc1F"}, {"compound_id": "LB-873077685BDE", "smiles": "CCOc1ccc(Nc2nc(=O)c(OC)cn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-0CDEB0554A6E", "smiles": "O=c1nc(Nc2cccc3c(=O)[nH]ccc23)n(Cc2cc(F)cc(F)c2)cc1F"}, {"compound_id": "LB-34A146EE21C8", "smiles": "Cc1cc(Nc2nc(=O)c(Cl)cn2Cc2cc(F)cc(F)c2)c2cc[nH]c2c1"}, {"compound_id": "LB-50F2D56E933D", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-B2C02555E0F7", "smiles": "COc1cn(Cc2ccsc2)c(Nc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-46D65AEB7A5B", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)OCO3)nc1=O"}, {"compound_id": "LB-7AC708639B98", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3nc(C)sc3cc2C)nc1=O"}, {"compound_id": "LB-876E49490ABD", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(S(C)(=O)=O)cc(C)c2C)nc1=O"}, {"compound_id": "LB-22803D10DF12", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3ncccc3cc2C)nc1=O"}, {"compound_id": "LB-21E3DB7AF9BD", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3ncccc3cc2C)nc1=O"}, {"compound_id": "LB-1928EFEC975E", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)c(Cl)cn3Cc3ccccc3)cc2s1"}, {"compound_id": "LB-C557E893DE46", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)c(F)cn3Cc3ccccc3)cc2s1"}, {"compound_id": "LB-D5E0AF9E956F", "smiles": "CCOc1cc(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c(C)cc1C"}, {"compound_id": "LB-85840A9924DD", "smiles": "CCc1cc(F)c(OC)cc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-F4D2E0EFCDAC", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(Cl)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-F8E22A16AF1E", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc3oc(C)cc3c2C)nc1=O"}, {"compound_id": "LB-91348200B7FF", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2c(C)cc3oc(C)cc3c2C)nc1=O"}, {"compound_id": "LB-3583683BA1A8", "smiles": "Cc1cc(OC(F)F)c(C)cc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-F5DD2F488F0E", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c(C)c1"}, {"compound_id": "LB-3896597D6E0F", "smiles": "Cc1ccc(-c2ncco2)cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-9DD133DE31C4", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc3ncsc3c2C)nc1=O"}, {"compound_id": "LB-1C1791D30D04", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc3nc(C)sc3c2C)nc1=O"}, {"compound_id": "LB-D383EED78975", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3c(cc2C)OCC3)nc1=O"}, {"compound_id": "LB-52158E64F6FE", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc3c(c2C)COC3)nc1=O"}, {"compound_id": "LB-4D4A9D372E8C", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3c(cc2C)COC3)nc1=O"}, {"compound_id": "LB-85E02BBF4339", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)OCC=C3)nc1=O"}, {"compound_id": "LB-A112FBC7FE27", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)OCCC3)nc1=O"}, {"compound_id": "LB-D4DB4B730251", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(C)c(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-2212B0C021F4", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2c(C)ccc(C)c2F)nc1=O"}, {"compound_id": "LB-F49C90C3E4AD", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3scnc3cc2C)nc1=O"}, {"compound_id": "LB-1623B96E9F4B", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc3[nH]ccc3c2C)nc1=O"}, {"compound_id": "LB-1E3C74E3822F", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-FCF1D3328691", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3cc[nH]c3cc2C)nc1=O"}, {"compound_id": "LB-9F8523430A23", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Oc2cc(-c3ncco3)ccc2C)nc1=O"}, {"compound_id": "LB-72A23E0BA16D", "smiles": "COc1cc(C)c(Nc2cc(=O)c(OC)cn2Cc2ccccc2)cc1C"}, {"compound_id": "LB-8225E3A6C489", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(-c3ncco3)ccc2C)cc1=O"}, {"compound_id": "LB-A6C15D19E050", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C#N)ccc2C)cc1=O"}, {"compound_id": "LB-E021B565B309", "smiles": "COc1ccc(C)c(Oc2cc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1"}, {"compound_id": "LB-8BA9F5335B0D", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Oc2cc(-c3ncco3)ccc2C)cc1=O"}, {"compound_id": "LB-1CB57A03B404", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Oc2cc3sc(C)nc3cc2C)cc1=O"}, {"compound_id": "LB-5511D12BDC63", "smiles": "COc1cnc(Nc2cccc(Cl)c2C)n(Cc2ccccc2)c1=O"}, {"compound_id": "LB-056FE479F9CA", "smiles": "COc1cc(C)c(Nc2ncc(OC)c(=O)n2Cc2ccc(F)c(Cl)c2)cc1C"}, {"compound_id": "LB-775BAD49C474", "smiles": "COc1cnc(Nc2cc(N3CCCC3=O)ccc2C)n(Cc2ccc(F)c(Cl)c2)c1=O"}, {"compound_id": "LB-AEB9C53942A8", "smiles": "COc1cnc(Nc2cc3sc(C)nc3cc2C)n(Cc2ccc(F)c(Cl)c2)c1=O"}, {"compound_id": "LB-416E6FECF2AE", "smiles": "COc1cnc(Nc2cc(C)cc3[nH]ccc23)n(Cc2ccc(F)c(Cl)c2)c1=O"}, {"compound_id": "LB-DD3EED10E26A", "smiles": "Cc1c(Cl)cccc1Nc1cc(=O)n(C)c(=O)n1Cc1ccccc1"}, {"compound_id": "LB-BA552F95D6AA", "smiles": "COc1cc(C)c(Nc2cc(=O)n(C)c(=O)n2Cc2cc(F)c(F)c(F)c2)cc1C"}, {"compound_id": "LB-F8D996D53F00", "smiles": "Cn1ccc2c(Nc3nc(=O)c(F)cn3Cc3ccc(F)c(Cl)c3)cccc21"}, {"compound_id": "LB-B79D90629427", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-1FAB3CF99E15", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1)COC2"}, {"compound_id": "LB-42D3B83BE414", "smiles": "COc1cc(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c(C)cc1F"}, {"compound_id": "LB-2BB548B2D69A", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2ccc(F)c(Cl)c2)c(C)n1"}, {"compound_id": "LB-1E5AD7DC3486", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-B4BB48F3E69C", "smiles": "COc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)cc1C(C)C"}, {"compound_id": "LB-09A748A9B4A8", "smiles": "O=C1CCCc2c(Nc3nc(=O)c(F)cn3Cc3cc(F)c(F)c(F)c3)cccc21"}, {"compound_id": "LB-3AD4D01BCCE8", "smiles": "C=Cc1ccccc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-D55A329F382F", "smiles": "Cc1ccc(-c2nnco2)cc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-387EC8798AD6", "smiles": "Cc1cc(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)c(C)nc1OC(F)F"}, {"compound_id": "LB-7C65BE56CF8E", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)c(C)nn3Cc3cc(F)c(F)c(F)c3)cc2s1"}, {"compound_id": "LB-44F8D035920E", "smiles": "COc1cc(C)c(Nc2nc(=O)c(C)nn2Cc2cc(F)cc(F)c2)cc1OC"}, {"compound_id": "LB-2A556ECE3A13", "smiles": "Cc1c(Nc2nc(=O)cnn2Cc2cc(F)c(F)c(F)c2)ccc2[nH]ccc12"}, {"compound_id": "LB-2D11DEE23C14", "smiles": "COc1cc(C)c(Nc2nc(=O)cnn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-6EE34D0CC85C", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=NC#N"}, {"compound_id": "LB-C034B11E75F9", "smiles": "Cc1ccc(C)c(Nc2nc(=NO)c(F)cn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-DDF7DC68E4F0", "smiles": "Cc1ccc(F)cc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-3252355BBC4D", "smiles": "COc1ccc(F)c(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-856A24B334A5", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c(C)c1F"}, {"compound_id": "LB-15B9B4C7B607", "smiles": "COc1cccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1C"}, {"compound_id": "LB-231B28A9F33A", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(Cl)cn1Cc1ccccc1"}, {"compound_id": "LB-97EBAE471174", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C)cn1Cc1ccccc1"}, {"compound_id": "LB-9E3E6E46BD89", "smiles": "Cc1ccccc1Cn1cc(O)c(=O)nc1Nc1cccc(C(F)(F)F)c1Cl"}, {"compound_id": "LB-E75E9F0DD2A2", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(OCC(F)(F)F)cn1Cc1ccccc1"}, {"compound_id": "LB-4C7677D9869C", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(=O)O)cn1Cc1ccccc1"}, {"compound_id": "LB-D32B9B6118AD", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(NC(=O)OC(C)(C)C)cn1Cc1ccccc1"}, {"compound_id": "LB-51C40DB95D7C", "smiles": "CCOC(=O)Cc1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-76B47EA7B39E", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CCO)cn1Cc1ccccc1"}, {"compound_id": "LB-E16CCB9AF910", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)O)cn1Cc1ccccc1"}, {"compound_id": "LB-111459F24F1F", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(N)=O)cn1Cc1ccccc1"}, {"compound_id": "LB-AB6DA176E1E2", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(Br)cn1Cc1ccccc1"}, {"compound_id": "LB-5345E3CF3044", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(-c2ccccc2)cn1Cc1ccccc1"}, {"compound_id": "LB-96D79B55BD1A", "smiles": "COc1cn(Cc2ccccc2)c(NCc2cccc(C(F)(F)F)c2Cl)nc1=O"}, {"compound_id": "LB-E8260D7D1781", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(C(F)(F)F)c2Cl)nc1=O"}, {"compound_id": "LB-3653F8177036", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cccc(C(F)(F)F)c2Cl)nc1=O"}, {"compound_id": "LB-F629EF90BBEC", "smiles": "COc1cn(Cc2cccc(F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-07E356F0F51A", "smiles": "COc1cn(Cc2ccccc2F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-E8EDB5022DDA", "smiles": "COc1cn(Cc2ccccc2C)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-60383BADAEE5", "smiles": "COc1cn(Cc2cccc(C)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-10CD7BDCA572", "smiles": "COc1cn(Cc2ccc(C)cc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-F6C07CBB9DC9", "smiles": "COc1cn(Cc2cccc(C#N)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-2DB5588ED678", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3c2CCNC3)nc1=O"}, {"compound_id": "LB-425244C418B4", "smiles": "COc1ccccc1Cn1cc(OC)c(=O)nc1Nc1cccc(Cl)c1C"}, {"compound_id": "LB-8A2978CE9A8E", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C#N)cn1Cc1ccc(F)cc1"}, {"compound_id": "LB-6A8F9C1A7E9F", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccccc2Cl)nc1=O"}, {"compound_id": "LB-31000BDC8724", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccccc2C)nc1=O"}, {"compound_id": "LB-F7A830E327D7", "smiles": "COc1cn(Cc2ccccc2)c(NCc2ccccc2C(F)(F)F)nc1=O"}, {"compound_id": "LB-F2B526D04EFB", "smiles": "COc1cn(Cc2ccccc2)c(NCc2ccccc2Oc2ccc(C)cc2)nc1=O"}, {"compound_id": "LB-B5E03A8A4010", "smiles": "COc1cn(Cc2ccccc2)c(NCc2ccccc2N(C)C)nc1=O"}, {"compound_id": "LB-14B76ABBF1AF", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)ccc2C)nc1=O"}, {"compound_id": "LB-48FAA9235BC1", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(N3CCCS3(=O)=O)ccc2C)nc1=O"}, {"compound_id": "LB-837A0E0AF5F9", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(Cl)cc2Cl)nc1=O"}, {"compound_id": "LB-512ACC477325", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(Cl)cc2C)nc1=O"}, {"compound_id": "LB-A518082B7589", "smiles": "COc1cn(Cc2ccccc2)c(NC2CCc3ccccc32)nc1=O"}, {"compound_id": "LB-1314061EA31B", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1"}, {"compound_id": "LB-2FAFA3368C8E", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(=O)NCC#N)cn1Cc1ccccc1"}, {"compound_id": "LB-12DFAE8226DD", "smiles": "COCCNC(=O)c1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-61CC21BAEED7", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(=O)NCCS(C)(=O)=O)cn1Cc1ccccc1"}, {"compound_id": "LB-574EE7756BCE", "smiles": "CCNC(=O)c1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-E0BC87CA45BC", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Cl)ccc2Cl)nc1=O"}, {"compound_id": "LB-DC97EF39A0E5", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(F)c2C)nc1=O"}, {"compound_id": "LB-2337B2D3AB6D", "smiles": "COc1cn(Cc2ccccc2)c(Nc2c(Cl)cccc2Cl)nc1=O"}, {"compound_id": "LB-5684D01C2331", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-1EAFCF8FBA79", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(C(F)(F)F)c2C)nc1=O"}, {"compound_id": "LB-58EEDDE356DD", "smiles": "COC(=O)c1cccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1C"}, {"compound_id": "LB-2B81348E2C82", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccccc2C(F)(F)F)nc1=O"}, {"compound_id": "LB-587F77EF0C25", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(F)ccc2C)nc1=O"}, {"compound_id": "LB-FFEB46D4600B", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(-n3cccc3)c2C)nc1=O"}, {"compound_id": "LB-0393007DC1D2", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Cl)ccc2C)nc1=O"}, {"compound_id": "LB-C3EB52D456D4", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(OC(F)F)c2C)nc1=O"}, {"compound_id": "LB-8DF9DDE434A6", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(C)c2C)nc1=O"}, {"compound_id": "LB-201EEE70E19C", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2Cl)nc1=O"}, {"compound_id": "LB-71A1C504C4D2", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-C25A1FC24016", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(=O)NCC(F)(F)F)cn1Cc1ccccc1"}, {"compound_id": "LB-2B5AEED17C93", "smiles": "COc1cn(CCCc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-00BD9D07E73C", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(=O)N(C)C)cn1Cc1ccccc1"}, {"compound_id": "LB-3CA0397BE3A6", "smiles": "CCc1cc(Br)ccc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-A3733033E8B6", "smiles": "COc1cn(Cc2ccccc2)c(NCc2ccccc2C)nc1=O"}, {"compound_id": "LB-D26F212774B3", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3occc23)nc1=O"}, {"compound_id": "LB-3B18933F81C1", "smiles": "CCc1ccccc1Nc1nc(=O)c(Cl)cn1Cc1ccccc1"}, {"compound_id": "LB-B695DBBF789B", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(C)cc2C)nc1=O"}, {"compound_id": "LB-70D3A9BC9F91", "smiles": "CCc1ccccc1Nc1nc(=O)c(Br)cn1Cc1ccccc1"}, {"compound_id": "LB-9555AFC8C84D", "smiles": "Cc1cccc(Nc2nc(=O)c(Br)cn2Cc2ccccc2)c1C"}, {"compound_id": "LB-3D5265D21C48", "smiles": "CCCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-7F15A549368D", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(CO)c2C)nc1=O"}, {"compound_id": "LB-04A54DAD94A7", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(=O)OC(C)(C)C)cn1Cc1ccccc1"}, {"compound_id": "LB-017B4DC2C2DC", "smiles": "Cc1cccc(Nc2nc(=O)c(C(=O)O)cn2Cc2ccccc2)c1Cl"}, {"compound_id": "LB-2E0438CFD093", "smiles": "COc1ccccc1CNc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-B3F1EB0B3AD2", "smiles": "CCc1ccccc1CNc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-8CE92384BCF4", "smiles": "COc1cccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1Cl"}, {"compound_id": "LB-BCE9E2EF9BBB", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3c2ccn3C)nc1=O"}, {"compound_id": "LB-EAE80AF76303", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccccc2Cc2ccccc2)nc1=O"}, {"compound_id": "LB-F53876799087", "smiles": "COc1cn(Cc2ccccc2Cl)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-3729C637F9CC", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-208BEE469DA5", "smiles": "COc1cn(Cc2ccc(Cl)cc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-DE1D3406CD79", "smiles": "Cc1cccc(Nc2nc(=O)c(F)cn2Cc2ccccc2)c1C"}, {"compound_id": "LB-7FACF19CB425", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(OC(C)C)c2C)nc1=O"}, {"compound_id": "LB-3EEBBB04D08A", "smiles": "COc1c(C)cccc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-502DC97A718D", "smiles": "COc1cn(Cc2ccccc2)c(NCc2c(C)cccc2C)nc1=O"}, {"compound_id": "LB-3A1816CA83AB", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(Cl)c(Cl)c2Cl)nc1=O"}, {"compound_id": "LB-51A93EE56C1B", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(OC(F)F)c2Cl)nc1=O"}, {"compound_id": "LB-EE3DE569DF02", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3[nH]c(C)cc23)nc1=O"}, {"compound_id": "LB-DD1E3212CEB6", "smiles": "CCOc1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-4CEBF3150BD9", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(Oc3ccccc3)c2C)nc1=O"}, {"compound_id": "LB-2DD206D13419", "smiles": "CCc1ccccc1Nc1nc(=O)c(F)cn1Cc1ccc(F)cc1"}, {"compound_id": "LB-8A1D765C06CF", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cccc(C)c2C)nc1=O"}, {"compound_id": "LB-36D6257CA31F", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(OC(C)C)cn1Cc1ccccc1"}, {"compound_id": "LB-39253605AB00", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-A76F84008E65", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Br)ccc2Cl)nc1=O"}, {"compound_id": "LB-10DCE96C5110", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Cl)cc(Cl)c2Cl)nc1=O"}, {"compound_id": "LB-5E2C3D35EE44", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)ccc2Cl)nc1=O"}, {"compound_id": "LB-63940F546291", "smiles": "COc1ccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c(C)c1"}, {"compound_id": "LB-6BEFC735A3EA", "smiles": "Cc1ccc(N2CCCS2(=O)=O)cc1Nc1nc(=O)c(F)cn1Cc1ccccc1"}, {"compound_id": "LB-192461704AC1", "smiles": "COC(=O)c1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1"}, {"compound_id": "LB-9C3B5CEA5EBB", "smiles": "COc1ccc(Cl)c(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1"}, {"compound_id": "LB-166A86DAAA5D", "smiles": "Cc1cccc(C)c1Nc1nc(=O)c(F)cn1Cc1ccccc1"}, {"compound_id": "LB-BFC37FF4CEDB", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Cl)c(Cl)cc2Cl)nc1=O"}, {"compound_id": "LB-51512F9B603B", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc([N+](=O)[O-])ccc2C)nc1=O"}, {"compound_id": "LB-245D57EACE92", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(O)ccc2Cl)nc1=O"}, {"compound_id": "LB-922E8388E14E", "smiles": "CCc1ccccc1Nc1nc(=O)c(F)cn1Cc1ccccc1"}, {"compound_id": "LB-83EC4DC0B386", "smiles": "Cc1cccc(Nc2nc(=O)c(Cl)cn2Cc2ccccc2)c1C"}, {"compound_id": "LB-D63A479B5531", "smiles": "CCc1cc(Cl)ccc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-91A36B613B21", "smiles": "COc1cn(Cc2ccccc2F)c(Nc2cc(C)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-AA66F0D72894", "smiles": "COc1cn(Cc2ccccc2Cl)c(Nc2cc(C)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-9A6E67F4A64B", "smiles": "COc1cn(Cc2ccc(Cl)cc2)c(Nc2cc(C)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-DAAEA31AD966", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cc(C)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-C1CB39F81F60", "smiles": "COc1cn(Cc2ccccc2)c(N[C@@H]2CCCc3ccccc32)nc1=O"}, {"compound_id": "LB-49280E35CEE5", "smiles": "CCc1ccc(Cl)cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-74809450EC9D", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(CO)ccc2C)nc1=O"}, {"compound_id": "LB-A4B5888A6157", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C(N)=O)ccc2Cl)nc1=O"}, {"compound_id": "LB-4DA8F69DE742", "smiles": "COc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2ccccc2)cc1OC"}, {"compound_id": "LB-6ABB906574DD", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(Br)cc2Cc2ccccc2)nc1=O"}, {"compound_id": "LB-A145C0F8AEAB", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(OC(C)C)cc2C)nc1=O"}, {"compound_id": "LB-982E34901F37", "smiles": "COc1cn(Cc2ccccc2Cl)c(Nc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-6E037653A594", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1Cl)CCC2"}, {"compound_id": "LB-B03145D19540", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(Oc3ccccn3)c2C)nc1=O"}, {"compound_id": "LB-2DA2A492D0A2", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)cc1"}, {"compound_id": "LB-FCEDEE30F452", "smiles": "COc1cn(Cc2ccccc2)c(N[C@@H]2CCc3ccccc32)nc1=O"}, {"compound_id": "LB-1424AFB6C1C8", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(N3CCOCC3)cc2C)nc1=O"}, {"compound_id": "LB-AEADBB418301", "smiles": "CCOc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccccc2)cc1C"}, {"compound_id": "LB-C5B509A817EA", "smiles": "CCc1ccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c(CC)c1"}, {"compound_id": "LB-A256DA798CE6", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(C(F)(F)F)cn1Cc1ccccc1"}, {"compound_id": "LB-172DC9BCA0A1", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(N(C)C)c2C)nc1=O"}, {"compound_id": "LB-3560870F7501", "smiles": "Cc1cc(C)c(Nc2nc(=O)c(C(=O)NC3CCOCC3)cn2Cc2ccccc2)cc1C"}, {"compound_id": "LB-41A675F763DF", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3[nH]ncc3cc2C)nc1=O"}, {"compound_id": "LB-960B0149AED6", "smiles": "CCc1ccccc1Nc1nc(=O)c(F)cn1Cc1cccc(Cl)c1"}, {"compound_id": "LB-4B69CDCCF2CC", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1ccc(Cl)c(F)c1"}, {"compound_id": "LB-21344F429C52", "smiles": "Cc1cc(C)c(Nc2nc(=O)c(C(=O)NCC(=O)N(C)C)cn2Cc2ccccc2)cc1C"}, {"compound_id": "LB-04EF32994409", "smiles": "COc1ccc(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c(C)c1"}, {"compound_id": "LB-3F9FC4C8898F", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-BB4F0081FD37", "smiles": "COc1ccc(Nc2nc(=O)c(OC)cn2Cc2cccc(Cl)c2)c(C)c1"}, {"compound_id": "LB-0BDA24967969", "smiles": "CCc1cc(OC)ccc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-376056CE5442", "smiles": "CCc1ccc(OC)cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-296C434FCB74", "smiles": "Cc1c(Cl)cccc1NC(=O)Cc1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-C39077EDDBA7", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-n3cccc3)ccc2C)nc1=O"}, {"compound_id": "LB-77686B28BF55", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3nnco3)ccc2C)nc1=O"}, {"compound_id": "LB-682841C19C45", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-8CBF140D647F", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc(N(C)C)cc2C)nc1=O"}, {"compound_id": "LB-0A83F5A6E114", "smiles": "CCc1ccc(OC)cc1Nc1nc(=O)c(OC)cn1Cc1cccc(F)c1"}, {"compound_id": "LB-EBA64A7D7633", "smiles": "CCc1ccc(OC)cc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)cc1"}, {"compound_id": "LB-1A3CD8BA5155", "smiles": "CCc1ccc(OC)cc1Nc1nc(=O)c(OC)cn1Cc1cccc(Cl)c1"}, {"compound_id": "LB-87CA5CCB36FE", "smiles": "COc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccc(F)cc2)cc1OC"}, {"compound_id": "LB-077FA4144936", "smiles": "COc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(F)c2)cc1OC"}, {"compound_id": "LB-433F68FBE434", "smiles": "COc1cn(Cc2ccc(Cl)c(F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-35EB01DD1FFA", "smiles": "Cc1cc(C)c(Nc2nc(=O)c(C(=O)NCc3ccccc3)cn2Cc2ccccc2)cc1C"}, {"compound_id": "LB-0D5F9D1F2C08", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-F43653842669", "smiles": "COc1cn(Cc2cccc(F)c2F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-7F3C10004C7F", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-82FFD95F50A8", "smiles": "COc1cn(Cc2cccc(F)c2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-E2EC52E064C5", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-26991D1CC533", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-0032412CDD71", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-750FD2B259C4", "smiles": "COc1cn(Cc2ccc(Cl)c(F)c2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-78FA59C60838", "smiles": "COc1cn(Cc2ccc(Cl)c(Cl)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-7C9D709FDE21", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)cc(C)c2C)nc1=O"}, {"compound_id": "LB-18962696B79F", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cc(C)c(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-CA8D39BADB70", "smiles": "COc1cn(Cc2ccccc2OC(F)(F)F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-FEC281F6707D", "smiles": "COc1cn(Cc2cccc(OC(F)(F)F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-76121C0E1B0D", "smiles": "COc1cc(C)c(Nc2nc(=O)c(Cl)cn2Cc2ccccc2)cc1OC"}, {"compound_id": "LB-BC060D759629", "smiles": "COc1cn(Cc2c(F)cccc2F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-1F3DA7849C4A", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc(C)c2C)nc1=O"}, {"compound_id": "LB-B18ECB73BD89", "smiles": "Cc1ccc(N2CCCS2(=O)=O)cc1Nc1nc(=O)c(Cl)cn1Cc1ccccc1"}, {"compound_id": "LB-654F82E04A5E", "smiles": "COc1cn(Cc2cc(Cl)cc(Cl)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-79D9DFAD3802", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(OC(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-354552DA9E89", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(OC(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-7B94AF6D3CD8", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1cccc(Cl)c1"}, {"compound_id": "LB-D393AA21EB94", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-8C2917FF3E66", "smiles": "COc1cn(Cc2cc(F)ccc2F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-F40EC7C1DB0F", "smiles": "COc1cn(Cc2ccc(F)cc2F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-F71711E2B15A", "smiles": "CNC(=O)Cc1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-76003D760BA7", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)N(C)C)cn1Cc1ccccc1"}, {"compound_id": "LB-7D57A8CC5388", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cc(C)ccc2C)nc1=O"}, {"compound_id": "LB-76ECF40EC193", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cc(C)ccc2C)nc1=O"}, {"compound_id": "LB-274BB6CFDDF3", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)NCCO)cn1Cc1ccccc1"}, {"compound_id": "LB-24D9691FEF8C", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)NC2CCOCC2)cn1Cc1ccccc1"}, {"compound_id": "LB-45EBA02D45CF", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)N2CCOCC2)cn1Cc1ccccc1"}, {"compound_id": "LB-094CEBCE683A", "smiles": "COCCNC(=O)Cc1cn(Cc2ccccc2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-483098F30DF2", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)NCc2ccccc2)cn1Cc1ccccc1"}, {"compound_id": "LB-F25DA3AF99C8", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)NC2COC2)cn1Cc1ccccc1"}, {"compound_id": "LB-08834B4DDA0C", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(CC(=O)NCC#N)cn1Cc1ccccc1"}, {"compound_id": "LB-C099F2FB48E4", "smiles": "COCc1cccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1C"}, {"compound_id": "LB-C2CAE60EA879", "smiles": "COCc1cccc(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1C"}, {"compound_id": "LB-70C0ABFD9BF5", "smiles": "COCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-75200A55FDBE", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-33F69BC85C13", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(F)c(F)cc2C)nc1=O"}, {"compound_id": "LB-6B8DF81BF902", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(F)c(F)cc2C)nc1=O"}, {"compound_id": "LB-D8B9DAE0EF2F", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-F55B31876BD2", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(F)cn1Cc1cccc(Cl)c1)OCCO2"}, {"compound_id": "LB-8EAB8350FCD3", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2ccc(C)cc2C)nc1=O"}, {"compound_id": "LB-218AF0981BCC", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2ccc(C)cc2C)nc1=O"}, {"compound_id": "LB-F9A05C90FBD6", "smiles": "Cc1ccc(-c2nnco2)cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(F)c1"}, {"compound_id": "LB-652F81B08961", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(C)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-7C03E9764DEC", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Br)ccc2C)nc1=O"}, {"compound_id": "LB-2AB4794E9052", "smiles": "CCc1ccc(Cl)cc1Nc1nc(=O)c(OC)cn1Cc1cccc(Cl)c1"}, {"compound_id": "LB-5543B25A7D62", "smiles": "CCc1ccc(Cl)cc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)cc1"}, {"compound_id": "LB-AFADF506FFE5", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-3062F7ED625C", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3c(=O)[nH]ccc23)nc1=O"}, {"compound_id": "LB-F732D5F17464", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(N3CCCC3=O)ccc2C)nc1=O"}, {"compound_id": "LB-091B98B1334A", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cccc3c(=O)[nH]ccc23)nc1=O"}, {"compound_id": "LB-1AADDB2EDEA2", "smiles": "CCc1cc(F)ccc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-1432D6ABE895", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cccc(N(C)C)c2C)nc1=O"}, {"compound_id": "LB-64E0E23E78EA", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc(C)c2C)nc1=O"}, {"compound_id": "LB-3890ECE6736E", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-6916B5484CE2", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c1"}, {"compound_id": "LB-DA6DEFE2F93A", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(N3CCN(C(=O)OC(C)(C)C)CC3)ccc2C)nc1=O"}, {"compound_id": "LB-1B27FA8A812D", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(N3CCN(C(=O)OC(C)(C)C)CC3)ccc2C)nc1=O"}, {"compound_id": "LB-8347252B091F", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(S(=O)(=O)Nc3ccccc3)c(F)cc2C)nc1=O"}, {"compound_id": "LB-B61215F059CF", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3nc4ncccc4o3)ccc2C)nc1=O"}, {"compound_id": "LB-1513D8594BD6", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(-c3nc4ncccc4o3)ccc2C)nc1=O"}, {"compound_id": "LB-62E12A5E5279", "smiles": "CCc1cc(F)ccc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-D4F46D0A5A40", "smiles": "COc1cn(Cc2ccccc2OC(F)F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-1EE59419D3EC", "smiles": "COc1cn(Cc2ccccc2COC(F)F)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-178DA14BFD5A", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Cl)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-A363A319AD6A", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(Cl)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-4B71735CD1D7", "smiles": "COc1cc(F)cc(Cn2cc(OC)c(=O)nc2Nc2cccc(Cl)c2C)c1"}, {"compound_id": "LB-B62510F6A434", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-C8C926792C6F", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc(N(C)C)c2C)nc1=O"}, {"compound_id": "LB-EA634AEE7822", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(Cl)c1"}, {"compound_id": "LB-A0FE14C5AD39", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cc(-c3nnco3)ccc2C)nc1=O"}, {"compound_id": "LB-97EA3E321895", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(C)ccc2C)nc1=O"}, {"compound_id": "LB-2DFCC4FF4968", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(NCc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-4682760DD090", "smiles": "CCc1ccccc1CNc1nc(=O)c(OC)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-F6A1042EE35C", "smiles": "CCOc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1"}, {"compound_id": "LB-85074BDD7E63", "smiles": "CCOc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cccc(Cl)c2)c1"}, {"compound_id": "LB-246E7F21587F", "smiles": "COc1cc(C)cc(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1C"}, {"compound_id": "LB-30DA3FE0CDB1", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cccc(C(F)(F)F)c2C)nc1=O"}, {"compound_id": "LB-9DAF4554C992", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc(C(F)(F)F)c2C)nc1=O"}, {"compound_id": "LB-A0B5F0FE1235", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc(OC(F)F)c2C)nc1=O"}, {"compound_id": "LB-22708C760599", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc(C)c2Cl)nc1=O"}, {"compound_id": "LB-38A88B8FC2E4", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc3sccc23)nc1=O"}, {"compound_id": "LB-80CFD0EDA5BE", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cccc3[nH]c(C)cc23)nc1=O"}, {"compound_id": "LB-E0A4279216C2", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(OCC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-7FCA864AB947", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cc(OCC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-9282A922EAEF", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(OCC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-708A7780DE35", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(OCC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-E1BAEE6FD6C6", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(OCC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-B92C423FCB19", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(OCC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-652A05CA6640", "smiles": "COc1ccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c(C)c1C"}, {"compound_id": "LB-C7973301E042", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C(C)(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-DFB91423859E", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C(C)(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-DC8D03442F79", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C)cc(C)c2C)nc1=O"}, {"compound_id": "LB-4EC79765A334", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc(C)c2Cl)nc1=O"}, {"compound_id": "LB-AB4F7CFEEB0F", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(C)c(F)cc2C)nc1=O"}, {"compound_id": "LB-68049609BA93", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(SC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-4714D75BAE41", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(S(C)(=O)=O)ccc2C)nc1=O"}, {"compound_id": "LB-857915F3FFDE", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc(OC(C)C)c2C)nc1=O"}, {"compound_id": "LB-0289E669FA8B", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cccc(OC(C)C)c2C)nc1=O"}, {"compound_id": "LB-6A002CF3DB96", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-161951A4F2BE", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(Cl)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-3C251389799F", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2ccc(N3CCOCC3)cc2C)nc1=O"}, {"compound_id": "LB-A57971E72E69", "smiles": "COc1cn(Cc2cc(C)cc(C)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-05FA65EE8981", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(-c3nnco3)ccc2C)nc1=O"}, {"compound_id": "LB-BDA24DBBFE7A", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(CN3CCCC3)ccc2C)nc1=O"}, {"compound_id": "LB-19CABC307C4E", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-n3c(C)ccc3C)ccc2C)nc1=O"}, {"compound_id": "LB-C4B10D3B319F", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(-n3c(C)ccc3C)ccc2C)nc1=O"}, {"compound_id": "LB-2072BF6B2ED1", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3[nH]c(-c4ccccc4)cc23)nc1=O"}, {"compound_id": "LB-D6AAB5C04A7D", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(C)c(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-6F1196B8CCAA", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2ccc(OC(C)C)cc2C)nc1=O"}, {"compound_id": "LB-1A55D488C5B2", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc(OC(C)C)cc2C)nc1=O"}, {"compound_id": "LB-3A3B86E10FCB", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc(OC(C)C)cc2C)nc1=O"}, {"compound_id": "LB-ADE6EAACEDD0", "smiles": "COc1ccc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c(C)c1"}, {"compound_id": "LB-BE7017BCE6EA", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-FB6EE0B74897", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(Cl)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-E0EE2F0A3EF7", "smiles": "CCc1cc(Cl)ccc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-59671B613AFD", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc(N3CCOCC3)cc2C)nc1=O"}, {"compound_id": "LB-58F06A9AEEAD", "smiles": "COc1ccc(Cl)c(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1"}, {"compound_id": "LB-2E4FD12DA50E", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(SC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-74C2D32A066D", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(S(C)(=O)=O)ccc2C)nc1=O"}, {"compound_id": "LB-34D7F76CB0C3", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc(N3CCOCC3)cc2C)nc1=O"}, {"compound_id": "LB-0142F9EBBFBA", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(S(C)(=O)=O)c(C)cc2C)nc1=O"}, {"compound_id": "LB-96AB51B7CEE3", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(N3CCCS3(=O)=O)ccc2C)nc1=O"}, {"compound_id": "LB-C4AFC4021CBC", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-0B33CA96C447", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-c3ncco3)ccc2C)nc1=O"}, {"compound_id": "LB-95B4D029A5ED", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(OC(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-045848B8CD35", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(OC(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-775228A712AE", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(OC(C)C)ccc2C)nc1=O"}, {"compound_id": "LB-B48AACEDEC47", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3ncco3)ccc2C)nc1=O"}, {"compound_id": "LB-F916C77E9BF3", "smiles": "COc1cn(Cc2cccc(F)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-2720F09B1B0C", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-22DC44AE2F71", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc(Cl)cc2C)nc1=O"}, {"compound_id": "LB-07D91C3F4CEF", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc(Cl)cc2C)nc1=O"}, {"compound_id": "LB-C477293A2240", "smiles": "CCc1ccc(F)cc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)cc1"}, {"compound_id": "LB-B21E4CBEBD8F", "smiles": "CCc1ccc(F)cc1Nc1nc(=O)c(OC)cn1Cc1cccc(Cl)c1"}, {"compound_id": "LB-07E4AF5ECA37", "smiles": "CCc1ccc(F)cc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-F88EA1CB3AED", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-BDEA974328BA", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc(OC(F)F)c2C)nc1=O"}, {"compound_id": "LB-A177E9DF2F80", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc(C)c2Cl)nc1=O"}, {"compound_id": "LB-FEA56EBC3F06", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc3[nH]c(C)cc23)nc1=O"}, {"compound_id": "LB-7DBF01E8C331", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc3[nH]ncc3cc2C)nc1=O"}, {"compound_id": "LB-638EBEE64DC0", "smiles": "COc1cn(Cc2cc(F)cc(C(F)(F)F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-814094E1E86E", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3cccn(C)c3=O)ccc2C)nc1=O"}, {"compound_id": "LB-227AB18F03C7", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3cccn(C)c3=O)c(F)cc2C)nc1=O"}, {"compound_id": "LB-35667F400F23", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(-c3cccn(C)c3=O)c(F)cc2C)nc1=O"}, {"compound_id": "LB-81B54D5D1E6A", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-c3cccn(C)c3=O)c(F)cc2C)nc1=O"}, {"compound_id": "LB-862978181786", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(Cl)ccc2C)nc1=O"}, {"compound_id": "LB-D19BB79ADEE6", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(Cl)ccc2C)nc1=O"}, {"compound_id": "LB-5C499ED1A2D7", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-D7872BD73B26", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc3[nH]c(C)cc23)nc1=O"}, {"compound_id": "LB-D49F4AD44444", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-c3nnco3)ccc2C)nc1=O"}, {"compound_id": "LB-6BAF0588A54B", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cccc3[nH]c(=O)ccc23)nc1=O"}, {"compound_id": "LB-DE62B998A3A4", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cccc3c(=O)[nH]ccc23)nc1=O"}, {"compound_id": "LB-BFD047BC162A", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(S(C)(=O)=O)c(C)cc2C)nc1=O"}, {"compound_id": "LB-5CBDA7CDCFC9", "smiles": "COc1ccc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c(C)c1"}, {"compound_id": "LB-96DAE1841246", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2ccc(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-0ACA5DD1348D", "smiles": "COc1c(C)ccc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c1C"}, {"compound_id": "LB-F2A1AEC7B9E2", "smiles": "CCc1cc(Cl)ccc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(Cl)c1"}, {"compound_id": "LB-ED151F4B453A", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2ccc(N3CCOCC3)cc2C)nc1=O"}, {"compound_id": "LB-6C7B720EDBFD", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-3F4A11A4CE64", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(N(C)C)cc2C)nc1=O"}, {"compound_id": "LB-EC5A20B71BBF", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cccc(Cl)c2)c1"}, {"compound_id": "LB-C984E6CCD29E", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-9A6E2E92B472", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-69B2DAE3EE45", "smiles": "CCc1cc(Br)ccc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-D86C0D83CA43", "smiles": "COc1cn(Cc2ccc(C(F)(F)F)c(F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-795804F75CA2", "smiles": "COc1cn(Cc2ccc(F)c(C(F)(F)F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-2762207E407C", "smiles": "COc1ccc(Cl)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-93471BD42833", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc3occc23)nc1=O"}, {"compound_id": "LB-329112C36CB6", "smiles": "COc1cn(Cc2cccc(F)c2)c(Nc2cccc(OC(F)F)c2C)nc1=O"}, {"compound_id": "LB-B51BBCE9232C", "smiles": "COc1cn(Cc2cccc(F)c2)c(Nc2cccc(C)c2Cl)nc1=O"}, {"compound_id": "LB-E4338FFF7AFB", "smiles": "COc1cn(Cc2cccc(F)c2)c(Nc2cc(C)ccc2C)nc1=O"}, {"compound_id": "LB-874985E32DCC", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(C)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-F722B23BC068", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(N3CCCC3=O)ccc2C)nc1=O"}, {"compound_id": "LB-452D2FA70480", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(N3CCCC3=O)ccc2C)nc1=O"}, {"compound_id": "LB-7C261E55EDF9", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(N3CCCC3=O)ccc2C)nc1=O"}, {"compound_id": "LB-ACA5256042D5", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(C)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-1D373852643C", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(C)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-77F6E6BA3E28", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc3c(=O)[nH]ccc23)nc1=O"}, {"compound_id": "LB-577AEC7A5F15", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(-n3cccc3)ccc2C)nc1=O"}, {"compound_id": "LB-4F4CD1B4254A", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-n3cccc3)ccc2C)nc1=O"}, {"compound_id": "LB-2F7888D8491E", "smiles": "CCc1cc(Br)ccc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(Cl)c1"}, {"compound_id": "LB-113848B87DD5", "smiles": "CCc1ccc(OC)cc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(Cl)c1"}, {"compound_id": "LB-5EDF1087440C", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3ccc(C)o3)ccc2C)nc1=O"}, {"compound_id": "LB-7BD3FB4F1F13", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(-c3ccc(C)o3)ccc2C)nc1=O"}, {"compound_id": "LB-965551726ECE", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cccc(OC(F)F)c2C)nc1=O"}, {"compound_id": "LB-1586BAD86039", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cccc(C)c2Cl)nc1=O"}, {"compound_id": "LB-A13784F1D2E8", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3cnccn3)ccc2C)nc1=O"}, {"compound_id": "LB-3038B3BD5722", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(Cl)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-7459CD68B705", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(-c3nnco3)ccc2C)nc1=O"}, {"compound_id": "LB-E00F8A4869E7", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(-c3ncco3)ccc2C)nc1=O"}, {"compound_id": "LB-9335235D1ADC", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-B950A459DAD6", "smiles": "CCc1ccccc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(F)c1"}, {"compound_id": "LB-23EB1CCE3935", "smiles": "CCOc1ccc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c(C)c1"}, {"compound_id": "LB-83CD1B3F963E", "smiles": "CCOc1ccc(Nc2nc(=O)c(OC)cn2Cc2cccc(Cl)c2)c(C)c1"}, {"compound_id": "LB-1CD142443698", "smiles": "CCOc1ccc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c(C)c1"}, {"compound_id": "LB-4ABA25DE266A", "smiles": "CCOc1ccc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c(C)c1"}, {"compound_id": "LB-FD1A1BD2E518", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc(SC)c2C)nc1=O"}, {"compound_id": "LB-C28AE54B74FE", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-c3cnccn3)ccc2C)nc1=O"}, {"compound_id": "LB-53D6DFB08A64", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2ccccc2C)nc1=O"}, {"compound_id": "LB-1DDBB2908DD5", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1)OCO2"}, {"compound_id": "LB-876548C80035", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cccc3c(=O)[nH]ccc23)nc1=O"}, {"compound_id": "LB-6D2D1729EF25", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3cccnc3)ccc2C)nc1=O"}, {"compound_id": "LB-333695EB4EA6", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(OC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-E41E8F2165CB", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(OC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-C042E3A5B6C2", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(OC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-7B364CF00B07", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(OC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-5F75DBF9DD7B", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(OC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-569D1F071EF0", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc3c(cc2C)OCCO3)nc1=O"}, {"compound_id": "LB-04C43871AC8D", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3c(cc2C)OC(F)(F)O3)nc1=O"}, {"compound_id": "LB-0B41114E99AA", "smiles": "COc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccccc2)cc1F"}, {"compound_id": "LB-3E6E0ECF5784", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3c(cc2C)OCO3)nc1=O"}, {"compound_id": "LB-FE867B464C1A", "smiles": "C=C(C)c1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c1"}, {"compound_id": "LB-61F6A68565C0", "smiles": "C=C(C)c1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1"}, {"compound_id": "LB-568F809802A6", "smiles": "COc1cn(Cc2ccccc2)c(Nc2c(C)cccc2C)nc1=O"}, {"compound_id": "LB-AE0340A19772", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3c(cc2C)OC(F)(F)O3)nc1=O"}, {"compound_id": "LB-DB7D3F3EFE2D", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)OC(F)(F)O3)nc1=O"}, {"compound_id": "LB-65F0040EC325", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1)OC(F)(F)O2"}, {"compound_id": "LB-7766292A2A82", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(F)c1)OC(F)(F)O2"}, {"compound_id": "LB-5BAFC8158D28", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1)OC(F)(F)O2"}, {"compound_id": "LB-FBEA914A6526", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C(C)(C)O)ccc2C)nc1=O"}, {"compound_id": "LB-88B326739B56", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(C(C)(C)O)ccc2C)nc1=O"}, {"compound_id": "LB-935B04D7B0F4", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(-c3ccnn3C)ccc2C)nc1=O"}, {"compound_id": "LB-D6E698D74095", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(-c3ccnn3C)ccc2C)nc1=O"}, {"compound_id": "LB-3CE2EE6F7EB5", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(N3CCOCC3)ccc2C)nc1=O"}, {"compound_id": "LB-DE87364EB192", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(N3CCOCC3)ccc2C)nc1=O"}, {"compound_id": "LB-5CD3C70CB457", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(N3CCOCC3)ccc2C)nc1=O"}, {"compound_id": "LB-9AF321ED295F", "smiles": "COc1ccc(Nc2nc(=O)c(OC)cn2Cc2ccc(F)cc2)c(C)c1"}, {"compound_id": "LB-68BE1DFDE541", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(N3CCOCC3)ccc2C)nc1=O"}, {"compound_id": "LB-03DD70CD22A2", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3c(cc2C)OCO3)nc1=O"}, {"compound_id": "LB-151DD51A2B36", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(F)c1)OCO2"}, {"compound_id": "LB-0B95677460BD", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3nc(C)sc3cc2C)nc1=O"}, {"compound_id": "LB-AD2A53125F14", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3nc(C)sc3cc2C)nc1=O"}, {"compound_id": "LB-408BB6CBC1B6", "smiles": "C=C(C)c1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(F)c2)c1"}, {"compound_id": "LB-B3D2C032F727", "smiles": "C=C(C)c1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c1"}, {"compound_id": "LB-E6073F5CE622", "smiles": "C=C(C)c1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-65413119CE20", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3cscn3)ccc2C)nc1=O"}, {"compound_id": "LB-BAA529FADE46", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(-c3cscn3)ccc2C)nc1=O"}, {"compound_id": "LB-F8C40BDC679F", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(S(C)(=O)=O)cc(C)c2C)nc1=O"}, {"compound_id": "LB-9984DECFDB82", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(S(C)(=O)=O)cc(C)c2C)nc1=O"}, {"compound_id": "LB-679B535182DE", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(S(C)(=O)=O)cc(C)c2C)nc1=O"}, {"compound_id": "LB-EF3C1A49F497", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(S(C)(=O)=O)cc(C)c2C)nc1=O"}, {"compound_id": "LB-DA5FFDB93801", "smiles": "CCOc1cn(Cc2ccccc2)c(Nc2cc(OC)c(OC)cc2C)nc1=O"}, {"compound_id": "LB-336868467AF2", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3nc(C)sc3cc2C)nc1=O"}, {"compound_id": "LB-F107497F5E33", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(C)c2F)nc1=O"}, {"compound_id": "LB-2BE46BC24488", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(-c3cccnc3)ccc2C)nc1=O"}, {"compound_id": "LB-F03FC410EF7D", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(-c3ccc(C)o3)ccc2C)nc1=O"}, {"compound_id": "LB-3FF2462E2EF9", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(-c3ccc(C)o3)ccc2C)nc1=O"}, {"compound_id": "LB-3D9480EEA6B2", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-c3ccc(C)o3)ccc2C)nc1=O"}, {"compound_id": "LB-32A03CEF9BEE", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc3ncccc3cc2C)nc1=O"}, {"compound_id": "LB-85BDD770782B", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc3ncccc3cc2C)nc1=O"}, {"compound_id": "LB-64A3A7150F3E", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc3ncccc3cc2C)nc1=O"}, {"compound_id": "LB-73E4F6C059D4", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C(C)(C)O)ccc2C)nc1=O"}, {"compound_id": "LB-14517BC3DE97", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(C(C)(C)O)ccc2C)nc1=O"}, {"compound_id": "LB-D795D05A134E", "smiles": "COc1cc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c(C)cc1F"}, {"compound_id": "LB-AFA4B3415DF1", "smiles": "COc1cc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c(C)cc1F"}, {"compound_id": "LB-CC699C83F843", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3ccnn3C)ccc2C)nc1=O"}, {"compound_id": "LB-1C0EF6D5763C", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(-c3ccnn3C)ccc2C)nc1=O"}, {"compound_id": "LB-BF68260BB786", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-c3ccnn3C)ccc2C)nc1=O"}, {"compound_id": "LB-B951DA14B2FB", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(C(C)(C)O)ccc2C)nc1=O"}, {"compound_id": "LB-905AB644315B", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1)OCCO2"}, {"compound_id": "LB-99720007D923", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1cc(F)cc(F)c1)OCCO2"}, {"compound_id": "LB-B1B4ACC2EB05", "smiles": "CCc1cc2c(cc1Nc1nc(=O)c(OC)cn1Cc1ccc(F)c(Cl)c1)OCCO2"}, {"compound_id": "LB-F25F6CFD58F3", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)c(OCC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-48D5E9C2D5AC", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)c(Cl)cc2F)nc1=O"}, {"compound_id": "LB-FA9AE032C6BC", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(N3CCCC3=O)ccc2C)nc1=O"}, {"compound_id": "LB-6FA286419AB4", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(C)c(OCC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-267FA3F91758", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C)c(OCC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-131FD08384BF", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(Cl)c(F)cc2C)nc1=O"}, {"compound_id": "LB-EDEA0A12B2A8", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(Cl)c(F)cc2C)nc1=O"}, {"compound_id": "LB-2F883DBEB7BE", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(Cl)c(F)cc2C)nc1=O"}, {"compound_id": "LB-B82AC05B8B2D", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(Cl)c(F)cc2C)nc1=O"}, {"compound_id": "LB-D94C09ABF235", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Cl)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-30E8D683BA46", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(Cl)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-4EB57E9BFC51", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(Cl)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-003E0CDD5D63", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(Cl)cc3[nH]ccc23)nc1=O"}, {"compound_id": "LB-44578BCC7ADC", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)OC(F)(F)C(F)(F)O3)nc1=O"}, {"compound_id": "LB-3594F80F6663", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc3c(c2C)OC(F)(F)C(F)(F)O3)nc1=O"}, {"compound_id": "LB-33697FA68892", "smiles": "COc1nc2ccc(Nc3nc(=O)c(OC)cn3Cc3ccc(F)c(Cl)c3)c(C)c2s1"}, {"compound_id": "LB-11BA237CD769", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(-c3ccccc3)ccc2C)nc1=O"}, {"compound_id": "LB-7F2145CA4104", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(-c3ccccc3)ccc2C)nc1=O"}, {"compound_id": "LB-850DF30DD9F8", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(-c3ccccc3)ccc2C)nc1=O"}, {"compound_id": "LB-A0D956D2A130", "smiles": "COc1nc2ccc(Nc3nc(=O)c(OC)cn3Cc3cc(F)cc(F)c3)c(C)c2s1"}, {"compound_id": "LB-00AC5730E3B4", "smiles": "COc1ccc(Nc2nc(=O)c(Cl)cn2Cc2ccc(F)c(Cl)c2)c(C)c1"}, {"compound_id": "LB-47A52A28D612", "smiles": "COc1ccc(Nc2nc(=O)c(Cl)cn2Cc2cc(F)cc(F)c2)c(C)c1"}, {"compound_id": "LB-AEBB82743C0E", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc3ncsc3c2C)nc1=O"}, {"compound_id": "LB-277C9CC696C6", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc3ncsc3c2C)nc1=O"}, {"compound_id": "LB-5799F6F81975", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc3nc(C)sc3c2C)nc1=O"}, {"compound_id": "LB-188860EEBF9C", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2ccc3nc(C)sc3c2C)nc1=O"}, {"compound_id": "LB-6D70595D0479", "smiles": "CCOc1cc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)c(F)c(F)c2)cc1F"}, {"compound_id": "LB-3C6919F4DE49", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(OC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-22B6EE68BBB9", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(OC(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-C858977024FE", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(OC(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-C0A2D7C2B4F2", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(OC(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-252519A3101B", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(OC(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-5F5B5E2CB6BF", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(OC(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-4A8F3B0781F9", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(OC(F)F)c(C)cc2C)nc1=O"}, {"compound_id": "LB-B9C9A01BABC5", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(OC(F)F)c(C)cc2C)nc1=O"}, {"compound_id": "LB-A5CDE1320519", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cccc3c2ccc(=O)n3C)nc1=O"}, {"compound_id": "LB-79FC76C55AF2", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc3c2ccc(=O)n3C)nc1=O"}, {"compound_id": "LB-860B51ED83DC", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(N3CCCC3)ccc2C)nc1=O"}, {"compound_id": "LB-B06713A9AF9E", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(N3CCCC3)ccc2C)nc1=O"}, {"compound_id": "LB-2560A9CEB3DE", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(N3CCCC3)ccc2C)nc1=O"}, {"compound_id": "LB-B2ACEB40E8A7", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(F)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-EAC8DB36978E", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(F)c(Cl)cc2C)nc1=O"}, {"compound_id": "LB-26524DC8A4AC", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(OC3CC3)ccc2C)nc1=O"}, {"compound_id": "LB-5C3FF1DE1D08", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cc(OC3CC3)ccc2C)nc1=O"}, {"compound_id": "LB-EBCA8E131698", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cc(OC3CC3)ccc2C)nc1=O"}, {"compound_id": "LB-785018552683", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc(OC3CC3)ccc2C)nc1=O"}, {"compound_id": "LB-0246EBF7A701", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(Oc3ccccn3)ccc2C)nc1=O"}, {"compound_id": "LB-32A73D396476", "smiles": "COc1cn(Cc2ccc(F)cc2)c(Nc2cc(Oc3ccccn3)ccc2C)nc1=O"}, {"compound_id": "LB-BFA658859FC4", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc3c(=O)n(C)ccc23)nc1=O"}, {"compound_id": "LB-06B4443639B9", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cccc3c(=O)n(C)ccc23)nc1=O"}, {"compound_id": "LB-CA41810E9AE0", "smiles": "COc1cn(Cc2ccc(F)c(F)c2)c(Nc2cccc3c(=O)n(C)ccc23)nc1=O"}, {"compound_id": "LB-B411C04F11BC", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2cccc3c(=O)n(C)ccc23)nc1=O"}, {"compound_id": "LB-E6E8880F7DE1", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cccc3c(=O)n(C)ccc23)nc1=O"}, {"compound_id": "LB-3C6DF59E515E", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)COC3)nc1=O"}, {"compound_id": "LB-BF563747EEB9", "smiles": "CCOc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(OC)c(OC)cc2CC)nc1=O"}, {"compound_id": "LB-EE0C60F5F465", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc3c(c2C)COC3)nc1=O"}, {"compound_id": "LB-BFDFC9FAEE27", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(Nc2cc3c(cc2C)OCCC3)nc1=O"}, {"compound_id": "LB-4D99688ED620", "smiles": "C#Cc1cc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c(C)cc1F"}, {"compound_id": "LB-BCF9D2744A4B", "smiles": "C#Cc1cc(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c(C)cc1F"}, {"compound_id": "LB-3AB6C23B89AB", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3c(cc2C)OCCC3)nc1=O"}, {"compound_id": "LB-BCEEDEC73EB9", "smiles": "CCOc1cc(Nc2nc(=O)c(OC)cn2Cc2ccccc2)c(C)cc1F"}, {"compound_id": "LB-8E11E12148D7", "smiles": "CCOc1cc(Nc2nc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c(C)cc1F"}, {"compound_id": "LB-C2A3A3495B94", "smiles": "CCOc1cc(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c(C)cc1F"}, {"compound_id": "LB-5EC16F42A8EA", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C)c(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-E00F41A456BB", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(C)c(OC(F)(F)F)cc2C)nc1=O"}, {"compound_id": "LB-8DDE94FD3A3B", "smiles": "COc1cn(Cc2ccccc2)c(Nc2c(C)ccc(C)c2F)nc1=O"}, {"compound_id": "LB-40EC269BC6AC", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3c(cc2C)OCCC3=O)nc1=O"}, {"compound_id": "LB-374CA9AAC5A0", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(N3CCOCC3)ccc2C)nc1=O"}, {"compound_id": "LB-BBBA179482A8", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(OCC(F)(F)F)ccc2C)nc1=O"}, {"compound_id": "LB-78847E90404E", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc(Oc3ccnc(F)c3)cc2C)nc1=O"}, {"compound_id": "LB-510A56AC3131", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3sc(C(F)F)nc3cc2C)nc1=O"}, {"compound_id": "LB-1E94325C59B4", "smiles": "COc1ccc(C)cc1Nc1nc(=O)c(OC)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-C30A0D84E34A", "smiles": "COc1ccc(Nc2cc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c(C)c1"}, {"compound_id": "LB-95CFA6759F28", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)c(F)cc2C)cc1=O"}, {"compound_id": "LB-B1A9648A09F6", "smiles": "COc1ccc(C)c(Nc2cc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1"}, {"compound_id": "LB-E20EB831B907", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C)c(OC(F)F)cc2C)cc1=O"}, {"compound_id": "LB-FEF622765827", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C)c(Cl)cc2C)cc1=O"}, {"compound_id": "LB-DB3BFB171D60", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(Cl)cc2C)cc1=O"}, {"compound_id": "LB-99999C9C106D", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(C)c(OC(F)F)cc2C)cc1=O"}, {"compound_id": "LB-31251F28AD8B", "smiles": "COc1ccc(C)c(Nc2cc(=O)c(OC)cn2Cc2ccccc2)c1"}, {"compound_id": "LB-C3C65314E74D", "smiles": "COc1cc(C)c(Nc2cc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)cc1C"}, {"compound_id": "LB-04CD2B4BA637", "smiles": "COc1ccc(Cl)c(Nc2cc(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)c1"}, {"compound_id": "LB-015A6716EB29", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc(C(F)(F)F)ccc2C)cc1=O"}, {"compound_id": "LB-1505919547C3", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2ccc(C#N)cc2C)cc1=O"}, {"compound_id": "LB-1D289AF508FA", "smiles": "COc1ccc(Nc2cc(=O)c(OC)cn2Cc2ccccc2)c(C)c1"}, {"compound_id": "LB-7012A637E8F2", "smiles": "COc1cc(C)c(Nc2c(Cl)c(=O)c(OC)cn2Cc2ccc(F)c(Cl)c2)cc1C"}, {"compound_id": "LB-E82D1F47AA4A", "smiles": "COc1cnc(Nc2cccc(Cl)c2C)n(Cc2cccc(Cl)c2)c1=O"}, {"compound_id": "LB-66219C0FF875", "smiles": "COc1cnc(Nc2cccc(Cl)c2C)n(Cc2ccc(F)c(Cl)c2)c1=O"}, {"compound_id": "LB-0DFA035D3169", "smiles": "COc1cnc(Nc2cccc(Cl)c2C)n(Cc2ccc(F)c(F)c2)c1=O"}, {"compound_id": "LB-657B2314F094", "smiles": "COc1cnc(Nc2cc(C)c(Cl)cc2C)n(Cc2ccccc2)c1=O"}, {"compound_id": "LB-B5CCA76A1F69", "smiles": "Cc1ccc(OC(F)F)cc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-CBBC6DA91C99", "smiles": "O=c1nc(Nc2cccc3c2CCN3)n(Cc2cc(F)c(F)c(F)c2)cc1F"}, {"compound_id": "LB-7E20CBA9C823", "smiles": "COCc1ccc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-1431AC6FDD47", "smiles": "Cc1ccc(OCC2CC2)cc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-5DBFCADF3C38", "smiles": "CCOc1ccc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-3CC2D9929699", "smiles": "Cc1nc2[nH]ccc2cc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-CA90E2806A02", "smiles": "Cc1nc2[nH]ccc2cc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-02F71A55F5B8", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1)COC2"}, {"compound_id": "LB-09C212CD3AB5", "smiles": "CCOc1cc(Nc2nc(=O)c(F)cn2Cc2ccc(F)c(Cl)c2)c(C)cc1F"}, {"compound_id": "LB-BB8D4519CE6D", "smiles": "CCOc1ccc(Nc2nc(=O)c(F)cn2Cc2ccc(F)c(Cl)c2)c(C)c1"}, {"compound_id": "LB-759ADE262381", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)c(C)n1"}, {"compound_id": "LB-FF79D3C0184D", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c(C)n1"}, {"compound_id": "LB-8BC87D380ABE", "smiles": "CCOc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)cc1F"}, {"compound_id": "LB-1783025FA249", "smiles": "Cc1cc(OC(F)F)ccc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-7DE9FD0EA6E1", "smiles": "CCOc1ccc(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c(C)c1"}, {"compound_id": "LB-3C8E8A113C17", "smiles": "CCOc1ccc(Nc2nc(=O)c(F)cn2Cc2ccc(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-615C4B7731CF", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2ccc(F)c(F)c2)c(C)n1"}, {"compound_id": "LB-F39F1D6568C8", "smiles": "Cc1ccc(N2CC3CCC2C3)cc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-DB203872799C", "smiles": "Cc1cc2cc(Nc3nc(=O)c(F)cn3Cc3ccc(F)c(Cl)c3)c(C)cc2[nH]1"}, {"compound_id": "LB-1A87FF388F59", "smiles": "Cc1cc2cc(Nc3nc(=O)c(F)cn3Cc3ccc(F)c(F)c3)c(C)cc2[nH]1"}, {"compound_id": "LB-D179537D0838", "smiles": "Cc1cc2cc(Nc3nc(=O)c(F)cn3Cc3cc(F)cc(F)c3)c(C)cc2[nH]1"}, {"compound_id": "LB-50CF6D3C26F5", "smiles": "CCOc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2ccc(F)c(Cl)c2)cc1F"}, {"compound_id": "LB-1CA2D9BB75DB", "smiles": "CCOc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)cc1F"}, {"compound_id": "LB-4ED1C8B30338", "smiles": "CCOc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2ccc(F)c(F)c2)cc1F"}, {"compound_id": "LB-851BD4539313", "smiles": "Cc1cc(OC(F)F)ccc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-E59967B94A19", "smiles": "Cc1cc(OC(F)F)ccc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-96ACE6F88D90", "smiles": "Cc1cc(OC(F)F)ccc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(F)c1"}, {"compound_id": "LB-712066D58B74", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-638763A730E0", "smiles": "COc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)cc1C(C)C"}, {"compound_id": "LB-3C6791C50B0D", "smiles": "O=c1nc(Nc2cccc3c2CCN3)n(Cc2cc(F)cc(F)c2)cc1F"}, {"compound_id": "LB-6260CE675251", "smiles": "COC(=O)/C=C/c1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-F1B336C854DA", "smiles": "CCOC(=O)c1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc(OC)cc2C)nc1=O"}, {"compound_id": "LB-78E201D94E6F", "smiles": "COc1cc(C)c(Nc2nc(=O)c(C(N)=O)cn2Cc2cc(F)c(F)c(F)c2)cc1C"}, {"compound_id": "LB-84FC9ACB5C16", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)c(CCO)cn3Cc3cc(F)c(F)c(F)c3)cc2s1"}, {"compound_id": "LB-1A6A7CC40201", "smiles": "Cc1nc2[nH]ccc2cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(F)c1"}, {"compound_id": "LB-11BAA4D6FFFD", "smiles": "Cc1nc2[nH]ccc2cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-DC1913A85E37", "smiles": "Cc1cc2[nH]ncc2cc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-A7971AD3A9C5", "smiles": "Cc1cc2[nH]ncc2cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(Cl)c1"}, {"compound_id": "LB-77BAA25FA939", "smiles": "Cc1cc2[nH]ncc2cc1Nc1nc(=O)c(F)cn1Cc1ccc(F)c(F)c1"}, {"compound_id": "LB-704F68525321", "smiles": "O=c1nc(Nc2cccc3cnccc23)n(Cc2cc(F)c(F)c(F)c2)cc1F"}, {"compound_id": "LB-45317E298BC0", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccccc2C)nc1=O"}, {"compound_id": "LB-D49E152E0233", "smiles": "Cc1ccccc1Nc1nc(=O)c(C)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-82EF3FEAE3B1", "smiles": "COc1ccc(Nc2nc(=O)c(C(=O)O)cn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-B953AEB77993", "smiles": "COc1ccc(Nc2nc(=O)c(C(N)=O)cn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-A890C2B4A14B", "smiles": "COc1cc(C)c(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)cc1F"}, {"compound_id": "LB-47E5985D57B7", "smiles": "Cc1cc(OC(F)(F)F)ccc1Nc1nc(=O)c(F)cn1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-3E1C5C8802F0", "smiles": "Cc1cc(OC(F)(F)F)ccc1Nc1nc(=O)c(F)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-75E27A17295C", "smiles": "COc1ccc(Nc2nc(=O)c(CCO)cn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-7C0DDBBBC650", "smiles": "CN1CCc2c(cccc2Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)C1"}, {"compound_id": "LB-67A71F327DAA", "smiles": "COc1ccc(Nc2nc(=O)c(C#N)cn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-B176EF00DB2C", "smiles": "COc1cc(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)c(C)nc1F"}, {"compound_id": "LB-27A6539DA6D8", "smiles": "COc1cc(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c(C)nc1F"}, {"compound_id": "LB-AE0AFABF2244", "smiles": "CCOC(=O)c1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-DFC9308D217C", "smiles": "CCOC(=O)c1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(OC)c(F)cc2C)nc1=O"}, {"compound_id": "LB-E119125685B0", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(C#N)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-DF8C730F8484", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc(OC(F)F)cc2C)nc1=O"}, {"compound_id": "LB-65FD0F8C077C", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(OCCO)ccc2C)nc1=O"}, {"compound_id": "LB-5E575E2E8FF4", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3c(cc2C)COC3)nc1=O"}, {"compound_id": "LB-E1415D1F6F1E", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(CCO)cn1Cc1cc(F)c(F)c(F)c1)COC2"}, {"compound_id": "LB-44A531D121E4", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(C(=O)O)cn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-19542B275CB9", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(-c3ncco3)ccc2C)nc1=O"}, {"compound_id": "LB-DD5EF169760F", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(C#N)cn1Cc1cc(F)c(F)c(F)c1)COC2"}, {"compound_id": "LB-7BB172FDC663", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(-c3nnco3)ccc2C)nc1=O"}, {"compound_id": "LB-CAD01E72DDAA", "smiles": "Cc1cc(N2CCOCC2)ccc1Nc1nc(=O)c(C)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-400E0519239E", "smiles": "COc1cc(F)c(Nc2nc(=O)c(C)cn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-E04BC3312D82", "smiles": "Cc1ccc(S(C)(=O)=O)cc1Nc1nc(=O)ccn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-CA5CF77AB294", "smiles": "COc1cc(C)c(Nc2nc(=O)c(C)c(C)n2Cc2cc(F)cc(F)c2)cc1OC"}, {"compound_id": "LB-1F98474570DF", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)cc(C)n3Cc3cc(F)c(F)c(F)c3)cc2s1"}, {"compound_id": "LB-309012EB11F5", "smiles": "Cc1cc(F)c(-c2cccn(C)c2=O)cc1Nc1nc(=O)ccn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-1EF329B984A0", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(OC)ccc2C)nc1=O"}, {"compound_id": "LB-5FC5B4ED24E2", "smiles": "COc1cc(Cl)c(Nc2nc(=O)c(C)cn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-B9E44C4178AA", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2ccc(OC)cc2C)nc1=O"}, {"compound_id": "LB-5EEC43884E27", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc3sc(C)nc3cc2C)nc1=O"}, {"compound_id": "LB-C6BAD1F60A72", "smiles": "COCc1cc(=O)nc(Nc2cc(OC)c(OC)cc2C)n1Cc1cc(F)cc(F)c1"}, {"compound_id": "LB-F49CD51692E6", "smiles": "Cc1ccc(-c2cccn(C)c2=O)cc1Nc1nc(=O)c(C)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-D7420E4608B9", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(OC)c(OC)cc2C)nc1=O"}, {"compound_id": "LB-CA7F4095C46B", "smiles": "Cc1ccc(OCCO)cc1Nc1nc(=O)c(C)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-F9B1F38365B0", "smiles": "COCc1cn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(Cl)c(OC)cc2C)nc1=O"}, {"compound_id": "LB-C8AA55617FCE", "smiles": "COCc1cc(=O)nc(Nc2cc(OC)c(OC)cc2C)n1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-2185E0B42C2D", "smiles": "Cc1cc(F)c(-c2cccn(C)c2=O)cc1Nc1nc(=O)c(C)cn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-46E8036CD075", "smiles": "Cc1cc(N2CCOCC2)ccc1Nc1nc(=O)ccn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-CC9970803854", "smiles": "COc1cc(C)c(Nc2nc(=O)ccn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-72496D852325", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(C#N)cn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-3027DF41C636", "smiles": "COc1cc(C)c(Nc2nc(=O)c(CF)nn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-776FEEBA416B", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(C(=O)O)nn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-011F18DB6DA1", "smiles": "COc1ccc(Nc2nc(=O)c(C(=O)O)nn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-091217F606EE", "smiles": "COc1cc(C)c(Nc2nc(=O)c(C(=O)O)nn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-3FBBE8FBE5CD", "smiles": "CCOC(=O)c1nn(Cc2cc(F)c(F)c(F)c2)c(Nc2cc(OC)c(OC)cc2C)nc1=O"}, {"compound_id": "LB-06F35623C8A8", "smiles": "Cc1ccc(F)cc1Nc1nc(=O)c(CO)nn1Cc1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-C2A6181A22B8", "smiles": "COc1cc(C)c(Nc2nc(=O)c(CO)nn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-A5FE6D81CC59", "smiles": "COc1cc(F)c(Nc2nc(=O)c(C)nn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-4DFF5461378F", "smiles": "COc1ccc(Nc2nc(=O)c(C)nn2Cc2cc(F)c(F)c(F)c2)c(C)n1"}, {"compound_id": "LB-6873AA03CA03", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)c(C)nn3Cc3cc(F)cc(F)c3)cc2s1"}, {"compound_id": "LB-1FF2537930DB", "smiles": "COc1ccc(Nc2nc(=O)c(Cl)nn2Cc2cc(F)c(F)c(F)c2)c(C)c1"}, {"compound_id": "LB-3E38C5750910", "smiles": "COc1cc(C)c(Nc2nc(=O)c(C)nn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-0C2E5A50F1DE", "smiles": "COc1ccc(Nc2nc(=O)cnn2Cc2ccc(Cl)c(F)c2)c(C)c1"}, {"compound_id": "LB-8E6E26303276", "smiles": "COc1ccc(Nc2nc(=O)cnn2Cc2cc(F)cc(Cl)c2)c(C)c1"}, {"compound_id": "LB-E47A09EFB47D", "smiles": "COc1ccc(Nc2nc(=O)cnn2Cc2ccccc2F)c(C)c1"}, {"compound_id": "LB-9E3B62E09F94", "smiles": "COc1ccc(Nc2nc(=O)cnn2Cc2ccccc2)c(C)c1"}, {"compound_id": "LB-EE49182395CC", "smiles": "COc1cc(C)c(Nc2nc(=NC#N)c(OC)cn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-71C8C2385EB5", "smiles": "COc1cc(C)c(Nc2nc(=NC#N)c(F)cn2Cc2cc(F)c(F)c(F)c2)cc1OC"}, {"compound_id": "LB-BB336BBD99B6", "smiles": "CN=c1nc(Nc2cc(C)ccc2C)n(Cc2cc(F)c(F)c(F)c2)cc1F"}, {"compound_id": "LB-6C86C5375A7B", "smiles": "CON=c1nc(Nc2cc3sc(C)nc3cc2C)n(Cc2cc(F)c(F)c(F)c2)cc1F"}, {"compound_id": "LB-52263E479EF2", "smiles": "CON=c1nc(Nc2cc(C)ccc2C)n(Cc2cc(F)c(F)c(F)c2)cc1F"}, {"compound_id": "LB-42EA68025A76", "smiles": "Cc1ccc(C)c(Nc2nc(=N)c(F)cn2Cc2cc(F)c(F)c(F)c2)c1"}, {"compound_id": "LB-7CA7437F7FD0", "smiles": "O=c1cc2n(c(Nc3cccc4ncccc34)n1)C(c1ccccc1)CO2"}, {"compound_id": "LB-F060ECAF9033", "smiles": "Cc1ccccc1Nc1nc(=O)cc2n1C(c1ccccc1)CCC2"}, {"compound_id": "LB-E54D01580238", "smiles": "COc1c2n(c(Nc3cccc(Cl)c3C)nc1=O)C(c1ccccc1)CCO2"}, {"compound_id": "LB-35711896604C", "smiles": "COc1c2n(c(Nc3cc4sc(C)nc4cc3C)nc1=O)C(c1ccccc1)CC2"}, {"compound_id": "LB-993004ECAD59", "smiles": "CCc1nc(OC)ccc1Nc1nc(=O)cc2n1C(c1cc(F)cc(F)c1)CC2"}, {"compound_id": "LB-55EF3F820426", "smiles": "COc1ccc(/N=c2\\[nH]c(=O)c(F)c3n2C(c2ccc(F)cc2)CC3)c(C)n1"}, {"compound_id": "LB-B00863B1EA50", "smiles": "C=Cc1c2n(c(Nc3ccc(OC)nc3C)nc1=O)C(c1cc(F)cc(F)c1)CC2"}, {"compound_id": "LB-A2885E7EAF4D", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)cc4n3C(c3ccccc3)CN4)cc2s1"}, {"compound_id": "LB-D038E084CD2A", "smiles": "Cc1cc2c(cc1Nc1nc(=O)c(F)c3n1C(c1cc(F)cc(F)c1)CC3)COC2"}, {"compound_id": "LB-06CC4F1561E5", "smiles": "Cc1cc(C)c(Nc2nc(=O)cc3n2C(c2ccccc2)CN3C)cc1C"}, {"compound_id": "LB-470497E85CD4", "smiles": "CCN1C(=O)N=C(Nc2cc(C)c(C)cc2C)N2C1=NCC2c1ccccc1"}, {"compound_id": "LB-3DCAD0548778", "smiles": "Cc1ccc(C#N)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-CF9DC1EAB3E1", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(C)c1F"}, {"compound_id": "LB-8E4BB22FEEA0", "smiles": "COc1cc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(C)cc1F"}, {"compound_id": "LB-38AEC4488001", "smiles": "COc1cc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)cc4)N23)c(C)cc1F"}, {"compound_id": "LB-B8FA7E8E9324", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)cc4)N23)c(C)c1F"}, {"compound_id": "LB-D189424ACA5C", "smiles": "CCc1nc(OC)ccc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-D21711224D1E", "smiles": "COCCOc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c1"}, {"compound_id": "LB-9ABD5095E075", "smiles": "Cc1ccc(CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-0BD79B738E7D", "smiles": "COc1nc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)cc1F"}, {"compound_id": "LB-51FD6E5072D0", "smiles": "Cc1cc2c(cc1NC1=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N13)COC2"}, {"compound_id": "LB-C331FCEF5CF4", "smiles": "Cc1cc(F)c(CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-2EFD04937128", "smiles": "Cc1ccc(OCCO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-8AB298EC2C5C", "smiles": "CCc1ccc(CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-B7FB1AC2BDBC", "smiles": "CN1C(=O)N=C(NCc2ccccc2)N2C1=NCC2c1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-89BFC585B621", "smiles": "Cc1ccc(OC(F)F)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-58E3CF582B54", "smiles": "COCc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c1"}, {"compound_id": "LB-8AAB9B01BDE1", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)cc2n1C(c1ccccc1)CCC2"}, {"compound_id": "LB-FF0FAE91423E", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)cc2n1C(c1ccccc1)CCO2"}, {"compound_id": "LB-DBA92F52F6CB", "smiles": "Cc1ccccc1Nc1nc(=O)cc2n1C(c1ccccc1)CC2"}, {"compound_id": "LB-858FD6457458", "smiles": "COc1ccc(C)c(Nc2nc(=O)cc3n2C(c2ccccc2)CC3)c1"}, {"compound_id": "LB-B16EB89A907B", "smiles": "COc1cc(C)c(Nc2nc(=O)cc3n2C(c2ccc(F)cc2)CC3)cc1OC"}, {"compound_id": "LB-D538E4E37DF2", "smiles": "COc1cc(C)c(Nc2nc(=O)cc3n2C(c2cccc(F)c2)CC3)cc1OC"}, {"compound_id": "LB-F79FB1CD6D40", "smiles": "COc1cc(C)c(Nc2nc(=O)cc3n2C(c2cc(F)c(F)c(F)c2)CC3)cc1OC"}, {"compound_id": "LB-843E5FE4DE24", "smiles": "COc1cc(C)c(Nc2nc(=O)cc3n2C(c2ccccc2)CC3)cc1F"}, {"compound_id": "LB-CFF5D1F9F5E4", "smiles": "COc1cc(C)c(Nc2nc(=O)cc3n2C(c2ccc(F)c(F)c2)CC3)cc1OC"}, {"compound_id": "LB-ABF9A4831B67", "smiles": "COc1cc(C)c(Nc2nc(=O)cc3n2C(c2ccccc2)CC3)cn1"}, {"compound_id": "LB-768764939AA9", "smiles": "COc1cc(C)c(Nc2nc(=O)c(OC)c3n2C(c2ccccc2)CC3)cc1C"}, {"compound_id": "LB-2EF1E2D540DD", "smiles": "COc1cc(Nc2nc(=O)cc3n2C(c2ccc(F)cc2)CC3)c(C)cc1Cl"}, {"compound_id": "LB-DDA4A447A21E", "smiles": "COc1ccc(Nc2nc(=O)cc3n2C(c2ccccc2)CC3)c(C)n1"}, {"compound_id": "LB-86386414E2A5", "smiles": "COc1cc(Nc2nc(=O)cc3n2C(c2ccccc2)CC3)c(C)cn1"}, {"compound_id": "LB-89CD01BD7D12", "smiles": "COc1c2n(c(Nc3cc4sc(C)nc4cc3C)nc1=O)C(c1ccc(F)cc1)CC2"}, {"compound_id": "LB-63B7CC456907", "smiles": "Cc1cc2c(cc1Nc1nc(=O)cc3n1C(c1ccccc1)CC3)COC2"}, {"compound_id": "LB-303261C37AE5", "smiles": "COc1cc(Nc2nc(=O)c(OC)c3n2C(c2ccccc2)CC3)c(C)cc1Cl"}, {"compound_id": "LB-42CF4ACB9AD0", "smiles": "COc1cc(Nc2nc(=O)c(OC)c3n2C(c2ccccc2)CC3)c(C)cc1F"}, {"compound_id": "LB-2F324EF32A02", "smiles": "COc1ccc(Nc2nc(=O)c(F)c3n2C(c2ccccc2)CC3)c(C)c1"}, {"compound_id": "LB-34387643C4A7", "smiles": "COc1ccc(Nc2nc(=O)cc3n2C(c2cc(F)cc(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-B482C8977715", "smiles": "COc1ccc(Nc2nc(=O)cc3n2C(c2cc(F)c(F)c(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-88151364B153", "smiles": "COc1nc(C)c(Nc2nc(=O)cc3n2C(c2cc(F)cc(F)c2)CC3)cc1C"}, {"compound_id": "LB-D3A01B891D5F", "smiles": "COc1ccc(Nc2nc(=O)c(OC)c3n2C(c2ccccc2)CC3)c(C)c1"}, {"compound_id": "LB-80E1064E1910", "smiles": "Cc1nc2cc(C)c(/N=c3\\[nH]c(=O)cc4n3C(c3cc(F)cc(F)c3)CC4)cc2s1"}, {"compound_id": "LB-19CAFAC0F135", "smiles": "CCOc1ccc(Nc2nc(=O)cc3n2C(c2cc(F)cc(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-CB520E6C0A9D", "smiles": "Cc1cc(OC(F)F)ccc1/N=c1\\[nH]c(=O)cc2n1C(c1cc(F)cc(F)c1)CC2"}, {"compound_id": "LB-3016C129CDC1", "smiles": "Cc1cc(OC(F)F)ccc1/N=c1\\[nH]c(=O)c(F)c2n1C(c1ccc(F)cc1F)CC2"}, {"compound_id": "LB-351830D13E42", "smiles": "COc1ccc(C)c(/N=c2\\[nH]c(=O)cc3n2C(c2cc(F)cc(F)c2)CC3)c1"}, {"compound_id": "LB-086BAD66348C", "smiles": "COc1cc(/N=c2\\[nH]c(=O)c(F)c3n2C(c2ccc(F)cc2F)CC3)c(C)cc1F"}, {"compound_id": "LB-37149D446360", "smiles": "COc1cc(/N=c2\\[nH]c(=O)cc3n2C(c2cc(F)cc(F)c2)CC3)c(C)cc1F"}, {"compound_id": "LB-1FE6C90130CE", "smiles": "COc1ccc(Nc2nc(=O)c(F)c3n2C(c2ccc(F)cc2F)CC3)c(C)c1"}, {"compound_id": "LB-99DF334978DE", "smiles": "COc1ccc(/N=c2\\[nH]c(=O)c(F)c3n2C(c2ccc(F)cc2F)CC3)c(C)n1"}, {"compound_id": "LB-69E3EC49D7FC", "smiles": "COc1ccc(/N=c2\\[nH]c(=O)cc3n2C(c2ccc(F)cc2)CC3)c(C)n1"}, {"compound_id": "LB-F6A99C62E693", "smiles": "COc1cnc(C)c(Nc2nc(=O)cc3n2C(c2cc(F)cc(F)c2)CC3)c1"}, {"compound_id": "LB-BDC102BA3D87", "smiles": "COc1nc(C)c(Nc2nc(=O)cc3n2C(c2cc(F)cc(F)c2)CC3)cc1F"}, {"compound_id": "LB-1E8EE72B6119", "smiles": "Cc1cc2c(cc1/N=c1\\[nH]c(=O)c(F)c3n1C(c1ccc(F)cc1F)CC3)COC2"}, {"compound_id": "LB-CAD4C9A0667E", "smiles": "CCOc1ccc(/N=c2\\[nH]c(=O)cc3n2C(c2ccc(F)cc2F)CC3)c(CC)n1"}, {"compound_id": "LB-449AAA5CAAF1", "smiles": "CCOc1ccc(/N=c2\\[nH]c(=O)c(F)c3n2C(c2ccc(F)cc2F)CC3)c(CC)n1"}, {"compound_id": "LB-75115419879D", "smiles": "COc1cnc(C)c(/N=c2\\[nH]c(=O)c(F)c3n2C(c2ccc(F)cc2)CC3)c1"}, {"compound_id": "LB-D53B7B3F76AA", "smiles": "COc1cnc(C)c(/N=c2\\[nH]c(=O)cc3n2C(c2ccc(F)cc2)CC3)c1"}, {"compound_id": "LB-F3E798FF3330", "smiles": "CCOc1ccc(/N=c2\\[nH]c(=O)c(F)c3n2C(c2ccc(F)cc2F)CC3)c(C)n1"}, {"compound_id": "LB-AF76E3DA1DDD", "smiles": "CCOc1nc(C)c(Nc2nc(=O)cc3n2C(c2ccc(F)cc2F)CC3)cc1F"}, {"compound_id": "LB-E9C206DA3886", "smiles": "CCOc1nc(C)c(Nc2nc(=O)c(F)c3n2C(c2ccc(F)cc2F)CC3)cc1F"}, {"compound_id": "LB-5C0D1AFF9451", "smiles": "COc1nc(C)c(Nc2nc(=O)cc3n2C(c2ccc(F)cc2F)CC3)cc1F"}, {"compound_id": "LB-463AE7418573", "smiles": "COc1ccc(Nc2nc(=O)c(Cl)c3n2C(c2cc(F)cc(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-760F6EF028AD", "smiles": "COc1ccc(Nc2nc(=O)c(Br)c3n2C(c2cc(F)cc(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-51A707014CF4", "smiles": "COc1ccc(Nc2nc(=O)c(C)c3n2C(c2cc(F)cc(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-01FFE98C9C01", "smiles": "Cc1[nH]c(=O)c(F)cc1Nc1nc(=O)cc2n1C(c1ccc(F)cc1F)CC2"}, {"compound_id": "LB-6F5762BF8D1A", "smiles": "COc1ccc(Nc2nc(=O)c(-c3ccccc3)c3n2C(c2cc(F)cc(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-267A4034E06E", "smiles": "COc1nc(C)c(Nc2nc(=O)cc3n2C(c2cc(F)c(F)c(F)c2)CC3)cc1F"}, {"compound_id": "LB-4DF798A021A2", "smiles": "CCc1c2n(c(Nc3ccc(OC)nc3C)nc1=O)C(c1cc(F)cc(F)c1)CC2"}, {"compound_id": "LB-2CCB268485F7", "smiles": "COc1nc(C)c(Nc2nc(=O)cc3n2C(c2ccc(F)c(Cl)c2)CC3)cc1F"}, {"compound_id": "LB-B78F5B4E628A", "smiles": "COc1ccc(/N=c2\\[nH]c(=O)c(F)c3n2C(c2cc(F)cc(F)c2)CC3)c(C)n1"}, {"compound_id": "LB-E10DA09853C8", "smiles": "CCOc1ccc(Nc2nc(=O)c(F)c3n2C(c2cc(F)cc(F)c2)CC3)c(CC)n1"}, {"compound_id": "LB-4A0B159D3585", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)c(F)c4n3C(c3cc(F)cc(F)c3)CC4)cc2s1"}, {"compound_id": "LB-1974E66DD9C8", "smiles": "Cc1nc2cc(C)c(Nc3nc(=O)cc4n3C(c3ccccc3)CN4C)cc2s1"}, {"compound_id": "LB-5D177B67314E", "smiles": "COc1ccc(Nc2nc(=O)cc3n2C(c2ccccc2)CN3C)c(C)c1"}, {"compound_id": "LB-C7DFE5A1051A", "smiles": "COc1ccc(C)c(Nc2nc(=O)cc3n2C(c2ccccc2)CN3C)c1"}, {"compound_id": "LB-960D317E321C", "smiles": "COc1ccc(Nc2nc(=O)c(F)c3n2C(c2cc(F)cc(F)c2)CC3)c(C)c1F"}, {"compound_id": "LB-4ACB06D8BF1A", "smiles": "CCN1C(=O)N=C(Nc2cc(C)c(C)cc2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-D4ED50CB514F", "smiles": "CCN1C(=O)N=C(Nc2ccc(C)nc2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-25B871581EE0", "smiles": "CN1C(=O)N=C(Nc2cc(C3CC3)nn2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-7A0EE07E18E0", "smiles": "Cc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)c(C)n1"}, {"compound_id": "LB-CA6A5BC39D4B", "smiles": "Cc1ccc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)c(F)c4)N23)c(C)n1"}, {"compound_id": "LB-38907D147564", "smiles": "COc1cc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)c(F)c4)N23)c(C)nc1OC"}, {"compound_id": "LB-A763C8F44F3C", "smiles": "CCN1C(=O)N=C(Nc2ccc(OC)nc2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-9F87DD80E707", "smiles": "CCN1C(=O)N=C(Nc2cc(OC)c(OC)nc2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-4042513FDC0D", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)cc4)N23)c(C)n1"}, {"compound_id": "LB-AA8BCCB182D0", "smiles": "Cc1ccc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)cc4)N23)c(C)n1"}, {"compound_id": "LB-0A14402FF72E", "smiles": "COc1cc(C)c(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)cc4)N23)cc1OC"}, {"compound_id": "LB-29D9B8963E1A", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)c(C)c1"}, {"compound_id": "LB-DCE363583F85", "smiles": "COc1cnc(C)c(Nc2nc(=O)c(F)c3n2C(c2cc(F)cc(F)c2)CC3)c1"}, {"compound_id": "LB-401ECE16CA86", "smiles": "COc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)c(F)c4)N23)c1"}, {"compound_id": "LB-33578D50B469", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)c(F)c4)N23)c(C)c1"}, {"compound_id": "LB-6AE18B28413A", "smiles": "COc1cc(C)c(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)c(F)c4)N23)cc1OC"}, {"compound_id": "LB-D4A8E8DB1320", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)c(F)c4)N23)c(C)n1"}, {"compound_id": "LB-FE77F875743D", "smiles": "COc1cc(Nc2nc(=O)cc3n2C(c2cc(F)cc(F)c2)CN3)c(C)cc1F"}, {"compound_id": "LB-2BF6AF5248AC", "smiles": "COc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)cc4)N23)c1"}, {"compound_id": "LB-94FC61461E2F", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4ccc(F)cc4)N23)c(C)c1"}, {"compound_id": "LB-452C6E97B247", "smiles": "COc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)c1"}, {"compound_id": "LB-77FAE84B45D5", "smiles": "COc1cc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)cc1OC"}, {"compound_id": "LB-4131DED7CF3E", "smiles": "COc1cc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)c(C)nc1OC"}, {"compound_id": "LB-C643A3313267", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(C)c1"}, {"compound_id": "LB-7FCAD4F9F3C5", "smiles": "COc1nc(C)c(Nc2nc(=O)c(F)c3n2C(c2cc(F)cc(F)c2)CC3)cc1C"}, {"compound_id": "LB-A37F48659F9E", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)c(C)c1F"}, {"compound_id": "LB-D0CC02912506", "smiles": "CCN1C(=O)N=C(Nc2cc(OC)c(OC)cc2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-9A68E0355872", "smiles": "CCN1C(=O)N=C(Nc2cc(OC)ccc2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-9947544F23F2", "smiles": "CCN1C(=O)N=C(Nc2ccc(OC)cc2C)N2C1=NCC2c1ccc(F)cc1"}, {"compound_id": "LB-FEF42385565A", "smiles": "COc1nc(C)c(Nc2nc(=O)c(F)c3n2C(c2cc(F)cc(F)c2)CC3)cc1F"}, {"compound_id": "LB-561189030CBD", "smiles": "COc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c1"}, {"compound_id": "LB-1E634C280D25", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(C)n1"}, {"compound_id": "LB-18D01FAD4AE8", "smiles": "COc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)c(C)n1"}, {"compound_id": "LB-BD87934A66D6", "smiles": "Cc1ccc(C#N)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)cc(F)c3)N12"}, {"compound_id": "LB-DD76015DD90D", "smiles": "COc1cc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)cc(F)c4)N23)c(C)cc1F"}, {"compound_id": "LB-74E43CDBE652", "smiles": "COc1cc(C)c(Nc2nc(=O)c(F)c3n2C(c2ccc(F)cc2)CN3C)cc1OC"}, {"compound_id": "LB-99524203207D", "smiles": "COc1cc(C)c(Nc2nc(=O)nc3n2C(c2cc(F)c(F)c(F)c2)CN3)cc1OC"}, {"compound_id": "LB-2BF2444892CE", "smiles": "CCc1nc(OC)ccc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)cc(F)c3)N12"}, {"compound_id": "LB-35C993C4E81F", "smiles": "Cc1nc2cc(C)c(NC3=NC(=O)N(C)C4=NCC(c5cc(F)c(F)c(F)c5)N34)cc2s1"}, {"compound_id": "LB-064281BC6B9B", "smiles": "CCOc1cc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(C)cc1F"}, {"compound_id": "LB-F91251C0675E", "smiles": "COc1nc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)cc1C"}, {"compound_id": "LB-46D390C5D5E4", "smiles": "COc1ccc(Nc2nc(=O)c(F)c3n2C(c2ccc(F)cc2)CN3C)c(C)n1"}, {"compound_id": "LB-086862286877", "smiles": "COc1ccc(Nc2nc(=O)c(F)c3n2C(c2cc(F)c(F)c(F)c2)CN3)c(C)n1"}, {"compound_id": "LB-EF39E5C080AF", "smiles": "CCOc1ccc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(CC)n1"}, {"compound_id": "LB-7F54472D6331", "smiles": "COc1ccc(C)c(Nc2nc(=O)c(F)c3n2C(c2cc(F)c(F)c(F)c2)CN3)c1"}, {"compound_id": "LB-C551D1A69310", "smiles": "COc1cc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(C)nc1OC"}, {"compound_id": "LB-4291866E0A98", "smiles": "COCCOc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(Cc4ccccc4)N23)c1"}, {"compound_id": "LB-29A92DCE1B97", "smiles": "COc1cc(C)c(Nc2nc(=O)n(C)c3ncn(Cc4ccccc4)c23)cc1OC"}, {"compound_id": "LB-394FE3E3030A", "smiles": "Cc1cc(F)c(OCCO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-6452EBEBD177", "smiles": "COc1ccc(C)c(Nc2nc(=O)n(C)c3ncn(Cc4ccccc4)c23)c1"}, {"compound_id": "LB-47326B7DD5F7", "smiles": "COc1ccc(Nc2nc(=O)n(C)c3ncn(Cc4ccccc4)c23)c(C)c1"}, {"compound_id": "LB-9DC4CDD3D696", "smiles": "Cc1ncc(CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-BFD0ECC2AE40", "smiles": "Cc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(Cc4ccccc4)N23)c1"}, {"compound_id": "LB-8684F233081E", "smiles": "Cc1ccc(CO)cc1NC1=NC(=O)NC2=NCC(c3cc(F)c(F)c(F)c3)N21"}, {"compound_id": "LB-93D1A29BD7C0", "smiles": "Cc1ccc(CO)cc1NC1=NC(=O)N(C)C2=NCC(Cc3ccccc3)N12"}, {"compound_id": "LB-DDB03E3B6850", "smiles": "CCc1ccc(CO)cc1NC1=NC(=O)NC2=NCC(c3cc(F)c(F)c(F)c3)N21"}, {"compound_id": "LB-17ECD8792BEB", "smiles": "Cc1ccc(CCCO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-40DD9F80F147", "smiles": "COc1nc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)cc1CO"}, {"compound_id": "LB-BF466DA038DC", "smiles": "CCc1ccc(CO)cc1NC1=NC(=O)N(C)C2=NCC(Cc3ccccc3)N12"}, {"compound_id": "LB-122B2A402FA6", "smiles": "Cc1ccc(CC(F)(F)CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-6B64AF44505D", "smiles": "Cc1ccc(O[C@H]2C[C@@H](CO)C2)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-ADECC2A11538", "smiles": "Cc1ccc(O[C@H]2C[C@H](CO)C2)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-4D1590907B83", "smiles": "Cc1cc2cnn(CCO)c2cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-2656677F0496", "smiles": "Cc1ccc(C#N)cc1NC1=NC(=O)N(CCO)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-D71D40998B25", "smiles": "Cc1ccc(OC[C@H]2C[C@H](O)C2)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-F3F4115C2B19", "smiles": "Cc1ccc(C=O)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-2F5432509C25", "smiles": "Cc1ccc(Oc2ccccn2)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-BB66276A809F", "smiles": "Cc1ccc(CCO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-D8DCE53BEFC8", "smiles": "Cc1ccc(CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)nc(F)c3)N12"}, {"compound_id": "LB-E81760CDDE73", "smiles": "CN1C(=O)N=C(NCc2ccccc2F)N2C1=NCC2c1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-1564F40DEFB4", "smiles": "CN1C(=O)N=C(NCc2cccc(F)c2)N2C1=NCC2c1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-3DB36E8DF368", "smiles": "CN1C(=O)N=C(NCc2ccc(F)cc2)N2C1=NCC2c1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-E332DE78B880", "smiles": "Cc1ccc(OCCS(C)(=O)=O)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-B67E5B02A5FB", "smiles": "Cc1ccc(OCC#N)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-2BA32A3A3562", "smiles": "COCCc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c1"}, {"compound_id": "LB-7B7A0BB230E6", "smiles": "COCC(F)(F)Oc1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c1"}, {"compound_id": "LB-9AEB9244BC64", "smiles": "Cc1ccc(OC(F)(F)CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-951AD640394C", "smiles": "COCC(F)(F)c1ccc(C)c(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c1"}, {"compound_id": "LB-CE9B184510D1", "smiles": "Cc1ccc(C(F)(F)CO)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-4D9F1B2C2269", "smiles": "COc1ccc([C@@H](C)NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)cc1"}, {"compound_id": "LB-25C057911011", "smiles": "Cc1cc(C#N)ccc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-4B601DA46C9A", "smiles": "COc1cc(NC2=NC(=O)N(C)C3=NCC(c4cc(F)c(F)c(F)c4)N23)c(C)cc1C#N"}, {"compound_id": "LB-287DC89FB6B8", "smiles": "CN1C(=O)N=C(Nc2cc(C#N)ccc2F)N2C1=NCC2c1cc(F)c(F)c(F)c1"}, {"compound_id": "LB-C73E38E6E1D7", "smiles": "Cc1cc(F)c(C#N)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-163EDF3B83F2", "smiles": "Cc1c(F)cc(C#N)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-D4DA9F9C0624", "smiles": "Cc1ccc(C2=NCCO2)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-032AFC6B6876", "smiles": "Cc1cc(F)c(C2=NCCO2)cc1NC1=NC(=O)N(C)C2=NCC(c3cc(F)c(F)c(F)c3)N12"}, {"compound_id": "LB-0AF1F26560F2", "smiles": "O=C1CCC(C(=O)NCc2cccc(Cl)c2Cl)c2cccnc21"}, {"compound_id": "LB-0CE9642422E7", "smiles": "O=C1CCC(C(=O)NCC2CCCCCC2)c2cccnc21"}, {"compound_id": "LB-E510DAA57EA5", "smiles": "Cc1cc(Cl)cc(Cl)c1CNC(=O)C1(O)CCC(=O)c2ncccc21"}, {"compound_id": "LB-E9EF2C7AD660", "smiles": "O=C1CC(C(=O)NCc2cccc(C(F)(F)F)c2Cl)c2cccnc21"}, {"compound_id": "LB-EF5ED30297C0", "smiles": "O=C(NCc1cccc(C(F)(F)F)c1Cl)C1(O)CCC(O)c2ncccc21"}, {"compound_id": "LB-033E59C7D2C9", "smiles": "O=C(NCc1cccc(Cl)c1Cl)C1CC(O)c2ncccc21"}, {"compound_id": "LB-F5523AF65D2C", "smiles": "O=C(O)CC1CCC(C(=O)NCc2cccc(C(F)(F)F)c2Cl)c2cccnc21"}, {"compound_id": "LB-17D2D3C14EF6", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)C1(F)CC(O)(CO)c2ncccc21"}, {"compound_id": "LB-04854978D08B", "smiles": "N[C@@]1(CO)CC[C@@](F)(C(=O)NCc2ccc(Cl)cc2Cl)c2cccnc21"}, {"compound_id": "LB-7F7BD3C623BC", "smiles": "O=C1COC[C@@]2(CC[C@@](F)(C(=O)NCc3ccc(Cl)cc3Cl)c3cccnc32)N1"}, {"compound_id": "LB-DCEAD013E8F3", "smiles": "Cc1cc(Cl)cc(Cl)c1CNC(=O)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-2CB4EB437FFE", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-ECDAB2C408A8", "smiles": "O=C(NCc1ccc(F)cc1Cl)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-5E517E2D6D18", "smiles": "O=C(NCc1c(F)cc(Cl)cc1Cl)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-DA8F87E4FE53", "smiles": "O=C(NCc1ccc(F)c(F)c1F)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-8F6C85A01405", "smiles": "O=C(NCc1c(F)cc(F)cc1F)[C@@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-B09F2F8112A9", "smiles": "O=C(NCc1ccc(F)cc1F)[C@@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-A7139E393A7A", "smiles": "O=C(NCc1ccc(F)cc1C(F)(F)F)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-2A4FDDE3C7D1", "smiles": "O=C(NCc1ccc(F)cc1C(F)(F)F)[C@@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-6E38B9622A65", "smiles": "O=C(NCc1ccc(Cl)cc1F)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-AE1F0E29A3AA", "smiles": "O=C(NCc1ccc(Br)cc1F)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-24CD4E140835", "smiles": "O=C(NCc1ccc(Br)cc1F)[C@@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-3C351854F73D", "smiles": "Cc1cc(Cl)cc(Cl)c1CNC(=O)[C@H]1C[C@H](O)c2ncccc21"}, {"compound_id": "LB-0F1D666B5CE1", "smiles": "O=C(NCc1cccc(C(F)(F)F)c1Cl)[C@H]1CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-0739446C658F", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-7A9AB9D9E70F", "smiles": "O=C(NCc1ccc(F)cc1Cl)[C@@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-E7C6DE2BC181", "smiles": "O=C(NCc1ccc(F)cc1Cl)[C@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-971159B423AF", "smiles": "O=C(NCc1c(F)cc(Cl)cc1Cl)[C@@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-7DC7DB29188F", "smiles": "O=C(NCc1c(F)cc(Cl)cc1Cl)[C@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-CD98F47128A2", "smiles": "O=C(NCc1ccc(F)c(F)c1F)[C@@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-C2CC37F89A35", "smiles": "O=C(NCc1ccc(F)c(F)c1F)[C@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-F2A64D750D08", "smiles": "O=C(NCc1ccc(Cl)cc1F)[C@@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-0567F0A0BA65", "smiles": "O=C(NCc1ccc(Cl)cc1F)[C@H]1CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-83E867632C6A", "smiles": "Cc1cc(Cl)cc(Cl)c1CNC(=O)[C@H]1C[C@@H](O)c2ncccc21"}, {"compound_id": "LB-E197A31D40E9", "smiles": "O=C(NCc1cccc(C(F)(F)F)c1Cl)[C@@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-65C4DA00D5FF", "smiles": "O=C(NCc1c(Cl)cc(Cl)cc1CO)[C@@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-D529A79CC3BA", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-3CE123496770", "smiles": "O=C(NCc1ccc(F)cc1Cl)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-79F98038AAAC", "smiles": "O=C(NCc1ccc(F)c(F)c1F)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-2F452576F2F4", "smiles": "O=C(NCc1ccc(F)cc1F)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-C1BF3A0DCD16", "smiles": "O=C(NCc1ccc(F)cc1C(F)(F)F)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-5F14554D9BB5", "smiles": "O=C(NCc1ccc(Cl)cc1F)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-1802067224FA", "smiles": "O=C(NCc1c(Cl)cc(C(F)(F)F)cc1Cl)[C@@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-55ED0A689ACD", "smiles": "O=C(NCc1c(Cl)cc(Cl)cc1C(F)F)[C@@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-73C256C2E7F7", "smiles": "O=C(NCc1c(F)cc(Cl)cc1Cl)[C@@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-60F31AF4702B", "smiles": "O=C(NCc1cccc(Cl)c1Cl)[C@@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-3F25CD9B2140", "smiles": "O=C(NCc1cccc(Cl)c1Cl)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-68BF947829A9", "smiles": "Cc1cccc(Cl)c1CNC(=O)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-A765E9BC7DB4", "smiles": "O=C(NCc1cc(F)c(F)cc1Cl)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-FB562F7C91A2", "smiles": "O=C(NCc1c(Cl)ccc(Cl)c1Cl)[C@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-38D076A6590E", "smiles": "Cc1ccc(CNC(=O)[C@]2(F)CC[C@@H](O)c3ncccc32)c(Cl)c1"}, {"compound_id": "LB-903B801778A2", "smiles": "O=C(NCc1ccc(F)cc1Cl)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-D0440CAF607A", "smiles": "O=C(NCc1ccc(F)c(F)c1F)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-6790A112E4A7", "smiles": "O=C(NCc1c(Cl)cccc1Cl)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-855A314CC4F3", "smiles": "O=C(NCc1ccc(F)cc1F)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-9C744976AC07", "smiles": "O=C(NCc1ccc(F)cc1C(F)(F)F)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-455682DC6E5C", "smiles": "O=C(NCc1ccc(Cl)cc1F)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-218083E9CAE5", "smiles": "C[C@@H](NC(=O)[C@@]1(F)CC[C@@H](O)c2ncccc21)c1ccc(Cl)cc1Cl"}, {"compound_id": "LB-1662353DDE17", "smiles": "O=C(NCc1ccc(Cl)cc1C(F)(F)F)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-48B8646DEA3F", "smiles": "Cc1cccc(Cl)c1CNC(=O)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-F8C8074913C5", "smiles": "O=C(NCc1cc(F)c(F)cc1Cl)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-0EFFC4F41E62", "smiles": "O=C(NCc1c(Cl)ccc(Cl)c1Cl)[C@@]1(F)CC[C@@H](O)c2ncccc21"}, {"compound_id": "LB-6EC2B1CC1800", "smiles": "Cc1ccc(CNC(=O)[C@@]2(F)CC[C@@H](O)c3ncccc32)c(Cl)c1"}, {"compound_id": "LB-E96F1515F90B", "smiles": "C[C@H](NC(=O)[C@]1(F)CC[C@H](O)c2ncccc21)c1ccc(Cl)c(Cl)c1Cl"}, {"compound_id": "LB-79B5742AF6A3", "smiles": "COc1ccc(CNC(=O)[C@]2(F)CC[C@H](O)c3ncccc32)c(Cl)c1"}, {"compound_id": "LB-0C54E6D86548", "smiles": "O=C(NCc1cc(Cl)ccc1Cl)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-2F271EB16440", "smiles": "O=C(NCc1ccccc1C(F)(F)F)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-4B98136E73BB", "smiles": "O=C(NCc1cc(F)c(F)c(F)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-DCD4FD8FBBAC", "smiles": "N#Cc1ccc(CNC(=O)[C@]2(F)CC[C@H](O)c3ncccc32)c(F)c1"}, {"compound_id": "LB-44EBB7F0764F", "smiles": "O=C(NCc1ccc(F)c(F)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-57ACF93C25BF", "smiles": "O=C(NCc1cc(F)cc(Cl)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-AC05CC58E0EF", "smiles": "O=C(NCc1cc(F)ccc1Cl)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-17703640CCEE", "smiles": "O=C(NCc1cccc(Cl)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-20CFCCA01596", "smiles": "O=C(NCc1ccc(Cl)c(F)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-89713FC4AEC9", "smiles": "O=C(NCc1ccc(OC(F)(F)F)cc1F)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-C06663E4B91B", "smiles": "O=C(NCc1cccc(F)c1F)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-9A5AD35044B7", "smiles": "O=C(NCc1cc(C(F)(F)F)ccc1Cl)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-1DB5B90A5C4D", "smiles": "O=C(NCc1ccc(Cl)cc1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-D1DEC2431B68", "smiles": "COc1ccc(CNC(=O)[C@]2(F)CC[C@H](O)c3ncccc32)c(C(F)(F)F)c1"}, {"compound_id": "LB-95EE42C89A37", "smiles": "O=C(NCc1cc(Cl)cc(Cl)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-9E167C0F6C36", "smiles": "O=C(NCc1nc(-c2ccc(Cl)cc2)cs1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-9A1E08BBFDF0", "smiles": "O=C(NCc1ccccc1CN1CCOCC1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-BE3B4E710FD5", "smiles": "O=C(N[C@H]1C[C@@H]1c1ccccc1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-EBFED16560DF", "smiles": "Cc1ccc(Cl)c(CNC(=O)[C@]2(F)CC[C@H](O)c3ncccc32)c1F"}, {"compound_id": "LB-D38FDDC89B26", "smiles": "O=C(NCc1c(F)cccc1F)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-1ED18446C2AA", "smiles": "O=C(N[C@H]1CCCc2ccccc21)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-A5A12469F5FF", "smiles": "O=C(NCCOc1cccc(C(F)(F)F)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-D3757DD521D4", "smiles": "O=C(NCC1(c2ccc(F)cc2)CC1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-77C855368755", "smiles": "O=C(NCc1cc(F)cc(F)c1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-31819228108D", "smiles": "O=C(N[C@@H]1C[C@H]1c1ccccc1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-F0AEDBE37040", "smiles": "O=C(NCc1ccccc1F)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-D0E5E9420509", "smiles": "COc1cccc(CNC(=O)[C@]2(F)CC[C@H](O)c3ncccc32)c1Cl"}, {"compound_id": "LB-9B6F6EBFE9AD", "smiles": "O=C(N[C@H]1CCC[C@@H]1OCc1ccccc1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-EF090ED287F6", "smiles": "O=C(N[C@H]1CCc2ccccc21)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-CFEEC3959BCC", "smiles": "CC(C)(C)CCNC(=O)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-2E3407F2A3A7", "smiles": "O=C(NCCOc1ccccc1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-6C978A8FDE53", "smiles": "O=C(NC1COc2ccccc2C1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-6E3865E91DAD", "smiles": "CC(CNC(=O)[C@]1(F)CC[C@H](O)c2ncccc21)c1ccc(Cl)cc1"}, {"compound_id": "LB-B363C4C0F1A0", "smiles": "O=C(NCC(c1ccccc1)N1CCOCC1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-834C985111FD", "smiles": "Cc1ncsc1C(CNC(=O)[C@]1(F)CC[C@H](O)c2ncccc21)N1CCC(F)(F)CC1"}, {"compound_id": "LB-6606F2E8AFA4", "smiles": "C[C@H](NC(=O)[C@]1(F)CC[C@H](O)c2ncccc21)c1ccc(F)cc1Cl"}, {"compound_id": "LB-111C0E9C4E12", "smiles": "O=C(NCC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@]1(F)CC[C@H](O)c2ncccc21"}, {"compound_id": "LB-EE7B5145A206", "smiles": "Cc1cnc2c(c1)[C@](F)(C(=O)NCc1ccc(Cl)cc1Cl)CC[C@@H]2O"}, {"compound_id": "LB-3CCCE8F85601", "smiles": "Cc1cnc2c(c1)[C@](F)(C(=O)NCc1ccc(F)cc1Cl)CC[C@@H]2O"}, {"compound_id": "LB-A3348898392A", "smiles": "O=C1CC[C@@](F)(C(=O)NCc2ccc(F)cc2Cl)c2cccnc21"}, {"compound_id": "LB-BBF77F97D636", "smiles": "O=C1CC[C@@](F)(C(=O)NCc2cccc(F)c2Cl)c2cccnc21"}, {"compound_id": "LB-8A1D763FD0B5", "smiles": "O=C1CC[C@@](F)(C(=O)NCc2ccc(F)c(F)c2F)c2cccnc21"}, {"compound_id": "LB-F4CBFC20D089", "smiles": "O=C1CC[C@@](F)(C(=O)NCc2ncc(Cl)cc2Cl)c2cccnc21"}, {"compound_id": "LB-EBC85B6BE6E0", "smiles": "C[C@@]1(O)CC[C@@](F)(C(=O)NCc2ccc(Cl)cc2Cl)c2cccnc21"}, {"compound_id": "LB-94A81DB1ACF7", "smiles": "C[C@@]1(O)CC[C@@](F)(C(=O)NCc2ccc(F)cc2Cl)c2cccnc21"}, {"compound_id": "LB-676716788A9A", "smiles": "C[C@H](NC(=O)[C@]1(F)CC[C@](C)(O)c2ncccc21)c1ccc(F)cc1Cl"}, {"compound_id": "LB-BD6FD5E4F3FD", "smiles": "C[C@@]1(O)CC[C@@](F)(C(=O)NCC2(N3CCOCC3)CCCCC2)c2cccnc21"}, {"compound_id": "LB-D73767296A38", "smiles": "Cc1cnc2c(c1)[C@](F)(C(=O)NCc1ccc(F)cc1Cl)CC[C@]2(C)O"}, {"compound_id": "LB-88A92BE6C879", "smiles": "CN(CCO)C[C@@]1(O)CC[C@](F)(C(=O)NCc2ccc(Cl)cc2Cl)c2cccnc21"}, {"compound_id": "LB-57E31C129DBE", "smiles": "N#CC[C@]1(O)CC[C@@](F)(C(=O)NCc2ccc(F)cc2Cl)c2cccnc21"}, {"compound_id": "LB-E5D68AA4D3AA", "smiles": "O=C1NC[C@]2(CC[C@@](F)(C(=O)NCc3ccc(Cl)cc3Cl)c3cccnc32)O1"}, {"compound_id": "LB-41963A0646B3", "smiles": "O=C1NC[C@@]2(CC[C@@](F)(C(=O)NCc3ccc(Cl)cc3Cl)c3cccnc32)O1"}, {"compound_id": "LB-0FC4333443BE", "smiles": "O=C1CO[C@@]2(CC[C@](F)(C(=O)NCc3ccc(Cl)cc3Cl)c3cccnc32)CN1"}, {"compound_id": "LB-94FBA2C3A72C", "smiles": "O=C1CO[C@@]2(CC[C@@](F)(C(=O)NCc3ccc(Cl)cc3Cl)c3cccnc32)CN1"}, {"compound_id": "LB-0F31CE8607CB", "smiles": "C[S+]([O-])C[C@]1(O)CC[C@@](F)(C(=O)NCc2ccc(F)cc2Cl)c2cccnc21"}, {"compound_id": "LB-CB05E21DD164", "smiles": "CS(=O)(=O)C[C@@]1(O)CC[C@@](F)(C(=O)NCc2ccc(Cl)cc2Cl)c2cccnc21"}, {"compound_id": "LB-F65576F82CD3", "smiles": "CS(=O)(=O)C[C@]1(O)CC[C@@](F)(C(=O)NCc2ccc(F)cc2Cl)c2cccnc21"}, {"compound_id": "LB-F56FBAB24FD9", "smiles": "O=C(NCc1ccc(F)cc1Cl)[C@]1(F)CC[C@@](O)(CS(=O)(=O)CCO)c2ncccc21"}, {"compound_id": "LB-78AC2EE5BAE7", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@]1(F)CC[C@](O)(CO)c2ncccc21"}, {"compound_id": "LB-54B8AD895F52", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-FC06853BFBB8", "smiles": "O=C(NCc1ccc(F)cc1Cl)[C@]1(F)CC[C@](O)(CO)c2ncccc21"}, {"compound_id": "LB-F11DC18B5AA5", "smiles": "O=C(NCc1ccc(F)c(F)c1F)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-02C43877712F", "smiles": "O=C(NCc1ccc(F)c(F)c1F)[C@]1(F)CC[C@](O)(CO)c2ncccc21"}, {"compound_id": "LB-290AA66EA59A", "smiles": "O=C(NCc1c(F)cc(Cl)cc1Cl)[C@]1(F)CC[C@](O)(CO)c2ncccc21"}, {"compound_id": "LB-74C3CD14910D", "smiles": "O=C(NCc1ccc(F)c(F)c1Cl)[C@]1(F)CC[C@](O)(CO)c2ncccc21"}, {"compound_id": "LB-F6CA9832D56A", "smiles": "O=C(NCc1ccc(Cl)cc1F)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-8DD010968EB9", "smiles": "O=C(NCc1ccc(Cl)cc1F)[C@]1(F)CC[C@](O)(CO)c2ncccc21"}, {"compound_id": "LB-2BF218F00BC1", "smiles": "O=C(NCc1ccc(F)cc1F)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-1CF9BFEE7318", "smiles": "O=C(NCc1ccc(Cl)c(F)c1F)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-2524DAA29F17", "smiles": "O=C(NCc1ccc(F)c(Cl)c1F)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-8BA5BB6AF334", "smiles": "O=C(NCc1c(F)cc(Cl)cc1F)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-4718D090F216", "smiles": "Cc1cnc2c(c1)[C@](F)(C(=O)NCc1ccc(Cl)cc1Cl)CC[C@@]2(O)CO"}, {"compound_id": "LB-E0030F52D2C4", "smiles": "C[C@@H](NC(=O)[C@]1(F)CC[C@](O)(CO)c2ncccc21)c1ccc(F)cc1Cl"}, {"compound_id": "LB-CE7EFFD48A6A", "smiles": "O=C(NCc1ncc(Cl)cc1Cl)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-75FE2EBA4047", "smiles": "O=C(NCCc1ccc(Cl)cc1Cl)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-5267F70E2DB7", "smiles": "O=C(NC1CC1c1ccc(Cl)cc1Cl)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-59C5CE0289D1", "smiles": "O=C(NCC1(c2ccc(Cl)cc2Cl)CCOCC1)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-989BA856E236", "smiles": "CO[C@H]1CC[C@](F)(C(=O)NCc2c(Cl)cc(Cl)cc2CO)c2cccnc21"}, {"compound_id": "LB-5877A706C276", "smiles": "CO[C@H]1CC[C@@](F)(C(=O)NCc2c(F)cc(F)cc2F)c2cccnc21"}, {"compound_id": "LB-139638218276", "smiles": "CO[C@H]1CC[C@@](F)(C(=O)NCc2ccc(F)cc2F)c2cccnc21"}, {"compound_id": "LB-E6CC80C562CC", "smiles": "O=C(NCc1ccc(F)cc1F)[C@]1(F)CC[C@H](OCCO)c2ncccc21"}, {"compound_id": "LB-68416EC786CB", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@]1(F)CC[C@@H](OCCO)c2ncccc21"}, {"compound_id": "LB-A297E705775B", "smiles": "O=C(NCc1ccc(Cl)cc1Cl)[C@@]1(F)CC[C@H](F)c2ncccc21"}, {"compound_id": "LB-A828EFFF3822", "smiles": "O=C(NCc1cccc(Cl)c1Cl)[C@@]1(F)CC[C@H](F)c2ncccc21"}, {"compound_id": "LB-6C0AD37F6648", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Nc2cc3sc(C)nc3cc2C)cc1=O"}, {"compound_id": "LB-46121BCB6A09", "smiles": "COc1cn(Cc2ccc(F)c(Cl)c2)c(Oc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-BFE811D10AC0", "smiles": "COc1cn(Cc2cc(F)cc(F)c2)c(NCc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-5087B27E54C0", "smiles": "COc1ccc(Nc2nc(=O)c(F)cn2Cc2cc(F)c(F)c(F)c2)c(C)c1F"}, {"compound_id": "LB-8E0529D90E54", "smiles": "Cc1c(Cl)cccc1Nc1nc(=O)c(OOC(C)(C)C)cn1Cc1ccccc1"}, {"compound_id": "LB-11E01BCAF20E", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cccc(C)c2Cl)nc1=O"}, {"compound_id": "LB-0DC3013D712B", "smiles": "COc1cn(Cc2ccccc2)c(Oc2cc(C)c(C)cc2C)nc1=O"}, {"compound_id": "LB-265369BB4EF2", "smiles": "COc1cn(Cc2cccc(OC(F)F)c2)c(Nc2cccc(Cl)c2C)nc1=O"}, {"compound_id": "LB-3FB29F36C289", "smiles": "COc1cn(Cc2ccccc2)c(Nc2cc(S(C)(=O)=O)c(C)cc2C)nc1=O"}, {"compound_id": "LB-BD485442AEF5", "smiles": "CCc1ccc(F)cc1Nc1nc(=O)c(OC)cn1Cc1ccccc1"}, {"compound_id": "LB-AA3C8F99A3D2", "smiles": "CCOc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(F)c2)c1"}, {"compound_id": "LB-3A21F0A035CE", "smiles": "CCOc1ccc(C)c(Nc2nc(=O)c(OC)cn2Cc2cc(F)cc(Cl)c2)c1"}, {"compound_id": "LB-A15D6FF506C2", "smiles": "COc1cn(Cc2cc(F)cc(Cl)c2)c(Nc2ccc(C)cc2C)nc1=O"}, {"compound_id": "LB-362CACB0F3C6", "smiles": "COc1cn(Cc2cccc(Cl)c2)c(Nc2cccc(C(F)(F)F)c2C)nc1=O"}, {"compound_id": "LB-C126E0A20359", "smiles": "COc1cn(Cc2cc(F)c(F)c(F)c2)c(Cc2cccc3[nH]c(=O)ccc23)nc1=O"}, {"compound_id": "LB-0A63D3E824C2", "smiles": "COC1CN(Cc2ccc(F)c(F)c2)C(Nc2cc(S(C)(=O)=O)c(C)cc2C)=NC1=O"}, {"compound_id": "LB-CE7E9C0CBE5A", "smiles": "COc1cn(Cc2ccccc2)c(Nc2ccc(C)cc2F)nc1=O"}, {"compound_id": "LB-3F39F0AF3FCA", "smiles": "CCOc1cc(Nc2nc(=O)c(F)cn2Cc2cc(F)cc(F)c2)c(C)cc1F"}, {"compound_id": "LB-4CD15561A033", "smiles": "CN(CCO)C[C@@]1(C)CC[C@](F)(C(=O)NCc2ccc(Cl)cc2Cl)c2cccnc21"}, {"compound_id": "LB-17A097A9653D", "smiles": "O=C(NCc1ccc(Cl)c(F)c1Cl)[C@]1(F)CC[C@@](O)(CO)c2ncccc21"}, {"compound_id": "LB-38067253A211", "smiles": "O=C(c1ccc(I)cc1)N1CCC(n2cncc2-c2ccc(OS(=O)(=O)c3cccc4cnccc34)cc2)CC1"}, {"compound_id": "LB-11663A097513", "smiles": "O=C(c1ccc(Br)cc1)N1CCC(n2cncc2-c2ccc(OS(=O)(=O)c3cccc4cnccc34)cc2)CC1"}, {"compound_id": "LB-4D62A8C4421D", "smiles": "C[C@H]1Cc2c(nnn2-c2ncccn2)CN1C(=O)c1ccnc(C(F)(F)F)c1F"}, {"compound_id": "LB-645872BDCF77", "smiles": "O=C(NCc1cccc(C(F)(F)F)c1Cl)[C@@H]1CCC(=O)N1C/C=C/I"}, {"compound_id": "LB-B024C40B324A", "smiles": "CS(=O)(=O)c1ccc(-c2ncc(C(=O)NCc3cn(-c4cc(C(F)(F)F)ccn4)nn3)s2)cc1"}, {"compound_id": "LB-2E1DCCFA9D71", "smiles": "CS(=O)(=O)c1ccc(-c2ncc(C(=O)NCc3cn(-c4cc(NC5CC(F)(F)C5)ccn4)nn3)s2)cc1"}, {"compound_id": "LB-3BE024EE9E8C", "smiles": "CS(=O)(=O)c1ccc(-c2ncc(C(=O)NCc3cn(-c4cc(N5CCC(F)(F)CC5)ccn4)nn3)s2)cc1"}, {"compound_id": "LB-1F41A274FB8B", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4cc(C(F)(F)F)ccn4)nn3)cs2)cc1"}, {"compound_id": "LB-CBF99358EA00", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4cc(NC5CC(F)(F)C5)ccn4)nn3)cs2)cc1"}, {"compound_id": "LB-6896A1C4A852", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4cc(N5CCC(F)(F)CC5)ccn4)nn3)cs2)cc1"}, {"compound_id": "LB-C9A589CF5D4A", "smiles": "CS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3cn(-c4cc(-c5cccc(C(F)(F)F)c5)ccn4)nn3)cs2)cc1"}, {"compound_id": "LB-B65FCEBAEBA9", "smiles": "C[C@H](NC(=O)c1cnc(-c2ccc(S(C)(=O)=O)cc2)s1)c1cn(-c2cc(C(F)(F)F)ccn2)nn1"}, {"compound_id": "LB-E658030DA550", "smiles": "C[C@H](NC(=O)c1csc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cn(-c2cc(C(F)(F)F)ccn2)nn1"}, {"compound_id": "LB-2966409E5EB2", "smiles": "C[C@@H](NC(=O)c1cnc(-c2ccc(S(C)(=O)=O)cc2)s1)c1cn(-c2cc(C(F)(F)F)ccn2)nn1"}, {"compound_id": "LB-4B60871ABBA2", "smiles": "C[C@@H](NC(=O)c1csc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cn(-c2cc(C(F)(F)F)ccn2)nn1"}]}
\ No newline at end of file