{"molecules": [{"atc_classifications": ["N05AX12"], "availability_type": 1, "biotherapeutic": null, "black_box_warning": 1, "chemical_probe": 0, "chirality": 2, "cross_references": [{"xref_id": "human/EPAR/aripiprazole-mylan-pharma-previously-aripiprazole-pharmathen", "xref_name": "aripiprazole-mylan-pharma-previously-aripiprazole-pharmathen", "xref_src": "EMA"}, {"xref_id": "human/EPAR/abilify-maintena", "xref_name": "abilify-maintena", "xref_src": "EMA"}, {"xref_id": "aripiprazole", "xref_name": "aripiprazole", "xref_src": "DailyMed"}, {"xref_id": "human/EPAR/aripiprazole-accord", "xref_name": "aripiprazole-accord", "xref_src": "EMA"}, {"xref_id": "human/EPAR/abilify", "xref_name": "abilify", "xref_src": "EMA"}, {"xref_id": "human/EPAR/aripiprazole-sandoz", "xref_name": "aripiprazole-sandoz", "xref_src": "EMA"}, {"xref_id": "human/EPAR/aripiprazole-zentiva", "xref_name": "aripiprazole-zentiva", "xref_src": "EMA"}], "dosed_ingredient": true, "first_approval": 2002, "first_in_class": 0, "helm_notation": null, "inorganic_flag": 0, "max_phase": "4.0", "molecule_chembl_id": "CHEMBL1112", "molecule_hierarchy": {"active_chembl_id": "CHEMBL1112", "molecule_chembl_id": "CHEMBL1112", "parent_chembl_id": "CHEMBL1112"}, "molecule_properties": {"alogp": "4.86", "aromatic_rings": 2, "full_molformula": "C23H27Cl2N3O2", "full_mwt": "448.39", "hba": 4, "hbd": 1, "heavy_atoms": 30, "mw_freebase": "448.39", "np_likeness_score": "-1.16", "num_ro5_violations": 0, "psa": "44.81", "qed_weighted": "0.61", "ro3_pass": "N", "rtb": 7}, "molecule_structures": {"canonical_smiles": "O=C1CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2N1", "molfile": "\n     RDKit          2D\n\n 30 33  0  0  0  0  0  0  0  0999 V2000\n    7.4956  -14.8744    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    6.4594  -14.2692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1566  -15.0126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8613  -14.2561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8689  -12.7561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1717  -12.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1769  -10.5118    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4785   -9.7663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4837   -8.2663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1873   -7.5117    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n    5.1894   -6.0109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8912   -5.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8933   -3.7570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.5951   -3.0039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.5973   -1.5031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n    1.2990   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.2990    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0000    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.2990    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.5981    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.8971    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.8971   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.9363   -1.3500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.5981   -1.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.2990   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.0000   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8856   -8.2573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    3.8804   -9.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    6.4669  -12.7692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    7.5092  -12.1745    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0\n  2  3  2  0\n  3  4  1  0\n  4  5  2  0\n  5  6  1  0\n  6  7  1  0\n  7  8  1  0\n  8  9  1  0\n  9 10  1  0\n 10 11  1  0\n 11 12  1  0\n 12 13  1  0\n 13 14  1  0\n 14 15  1  0\n 15 16  1  0\n 16 17  2  0\n 17 18  1  0\n 18 19  2  0\n 19 20  1  0\n 20 21  1  0\n 21 22  1  0\n 22 23  2  0\n 22 24  1  0\n 24 25  1  0\n 25 19  1  0\n 25 26  2  0\n 26 16  1  0\n 10 27  1  0\n 27 28  1  0\n 28  7  1  0\n  6 29  2  0\n 29  2  1  0\n 29 30  1  0\nM  END\n> <chembl_id>\nCHEMBL1112\n\n> <chembl_pref_name>\nARIPIPRAZOLE", "standard_inchi": "InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)", "standard_inchi_key": "CEUORZQYGODEFX-UHFFFAOYSA-N"}, "molecule_synonyms": [{"molecule_synonym": "Abilify", "syn_type": "TRADE_NAME", "synonyms": "ABILIFY"}, {"molecule_synonym": "Abilify asimtufii", "syn_type": "TRADE_NAME", "synonyms": "ABILIFY ASIMTUFII"}, {"molecule_synonym": "Abilify maintena", "syn_type": "TRADE_NAME", "synonyms": "ABILIFY MAINTENA"}, {"molecule_synonym": "Abilify maintena kit", "syn_type": "TRADE_NAME", "synonyms": "ABILIFY MAINTENA KIT"}, {"molecule_synonym": "Abilify mycite", "syn_type": "OTHER", "synonyms": "ABILIFY MYCITE"}, {"molecule_synonym": "Abilify mycite kit", "syn_type": "TRADE_NAME", "synonyms": "ABILIFY MYCITE KIT"}, {"molecule_synonym": "Aripiprazol", "syn_type": "INN_SPANISH", "synonyms": "ARIPIPRAZOL"}, {"molecule_synonym": "Aripiprazole", "syn_type": "ATC", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "BAN", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "BNF", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "EMA", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "FDA", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "INN", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "JAN", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "MERCK_INDEX", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "OTHER", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "TRADE_NAME", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "USAN", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole", "syn_type": "USP", "synonyms": "ARIPIPRAZOLE"}, {"molecule_synonym": "Aripiprazole accord", "syn_type": "TRADE_NAME", "synonyms": "ARIPIPRAZOLE ACCORD"}, {"molecule_synonym": "Aripiprazole mylan pharma (previously aripiprazole pharmathen)", "syn_type": "TRADE_NAME", "synonyms": "ARIPIPRAZOLE MYLAN PHARMA (PREVIOUSLY ARIPIPRAZOLE PHARMATHEN)"}, {"molecule_synonym": "Aripiprazole sandoz", "syn_type": "TRADE_NAME", "synonyms": "ARIPIPRAZOLE SANDOZ"}, {"molecule_synonym": "Aripiprazole zentiva", "syn_type": "TRADE_NAME", "synonyms": "ARIPIPRAZOLE ZENTIVA"}, {"molecule_synonym": "Aripiprex", "syn_type": "OTHER", "synonyms": "ARIPIPREX"}, {"molecule_synonym": "NSC-759266", "syn_type": "RESEARCH_CODE", "synonyms": "NSC-759266"}, {"molecule_synonym": "OPC-14597", "syn_type": "RESEARCH_CODE", "synonyms": "OPC-14597"}, {"molecule_synonym": "OPC-31", "syn_type": "RESEARCH_CODE", "synonyms": "OPC-31"}, {"molecule_synonym": "Opipza", "syn_type": "TRADE_NAME", "synonyms": "OPIPZA"}], "molecule_type": "Small molecule", "natural_product": 1, "oral": true, "orphan": 0, "parenteral": true, "polymer_flag": 0, "pref_name": "ARIPIPRAZOLE", "prodrug": 0, "structure_type": "MOL", "therapeutic_flag": true, "topical": false, "usan_stem": "-prazole", "usan_stem_definition": "antiulcer agents (benzimidazole derivatives)", "usan_substem": "-prazole", "usan_year": 1997, "veterinary": 0, "withdrawn_flag": false}], "page_meta": {"limit": 20, "next": null, "offset": 0, "previous": null, "total_count": 1}}