{"molecules": [{"atc_classifications": ["N05AL01"], "availability_type": -1, "biotherapeutic": null, "black_box_warning": 0, "chemical_probe": 0, "chirality": 0, "cross_references": [], "dosed_ingredient": false, "first_approval": null, "first_in_class": 0, "helm_notation": null, "inorganic_flag": 0, "max_phase": "4.0", "molecule_chembl_id": "CHEMBL26", "molecule_hierarchy": {"active_chembl_id": "CHEMBL26", "molecule_chembl_id": "CHEMBL26", "parent_chembl_id": "CHEMBL26"}, "molecule_properties": {"alogp": "0.56", "aromatic_rings": 1, "full_molformula": "C15H23N3O4S", "full_mwt": "341.43", "hba": 5, "hbd": 2, "heavy_atoms": 23, "mw_freebase": "341.43", "np_likeness_score": "-1.62", "num_ro5_violations": 0, "psa": "101.73", "qed_weighted": "0.79", "ro3_pass": "N", "rtb": 6}, "molecule_structures": {"canonical_smiles": "CCN1CCCC1CNC(=O)c1cc(S(N)(=O)=O)ccc1OC", "molfile": "\n RDKit 2D\n\n 23 24 0 0 0 0 0 0 0 0999 V2000\n 3.1792 -1.2042 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0\n 0.5292 -0.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -0.0208 0.6583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2.1042 -1.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.5792 -0.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -3.2000 0.6875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n -1.0458 0.6458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 3.1792 -2.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 3.1792 -0.1292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 0.0042 -1.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 4.2667 -1.2042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n -2.6833 -0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 0.5000 1.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -1.5958 -0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 1.5792 -2.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 0.5292 -2.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -4.2500 0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -1.0708 -1.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -2.7458 1.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -4.3458 -0.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -3.4000 -1.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -1.5958 -2.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n -3.3708 2.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 2 5 2 0\n 3 2 1 0\n 4 1 1 0\n 5 4 1 0\n 6 12 1 0\n 7 3 1 0\n 8 1 2 0\n 9 1 2 0\n 10 16 2 0\n 11 1 1 0\n 12 14 1 0\n 13 3 2 0\n 14 7 1 0\n 15 4 2 0\n 16 15 1 0\n 17 6 1 0\n 18 10 1 0\n 19 6 1 0\n 20 21 1 0\n 21 12 1 0\n 22 18 1 0\n 23 19 1 0\n 2 10 1 0\n 17 20 1 0\nM END\n> \nCHEMBL26\n\n> \nSULPIRIDE", "standard_inchi": "InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)", "standard_inchi_key": "BGRJTUBHPOOWDU-UHFFFAOYSA-N"}, "molecule_synonyms": [{"molecule_synonym": "Abilit", "syn_type": "TRADE_NAME", "synonyms": "ABILIT"}, {"molecule_synonym": "Aiglonyl", "syn_type": "TRADE_NAME", "synonyms": "AIGLONYL"}, {"molecule_synonym": "Coolspan", "syn_type": "TRADE_NAME", "synonyms": "COOLSPAN"}, {"molecule_synonym": "Dobren", "syn_type": "TRADE_NAME", "synonyms": "DOBREN"}, {"molecule_synonym": "Dogmatil", "syn_type": "TRADE_NAME", "synonyms": "DOGMATIL"}, {"molecule_synonym": "Dogmatyl", "syn_type": "TRADE_NAME", "synonyms": "DOGMATYL"}, {"molecule_synonym": "Dolmatil", "syn_type": "TRADE_NAME", "synonyms": "DOLMATIL"}, {"molecule_synonym": "Guastil", "syn_type": "TRADE_NAME", "synonyms": "GUASTIL"}, {"molecule_synonym": "Meresa", "syn_type": "TRADE_NAME", "synonyms": "MERESA"}, {"molecule_synonym": "Mirbanil", "syn_type": "TRADE_NAME", "synonyms": "MIRBANIL"}, {"molecule_synonym": "Misulvan", "syn_type": "TRADE_NAME", "synonyms": "MISULVAN"}, {"molecule_synonym": "N05AL01", "syn_type": "RESEARCH_CODE", "synonyms": "N05AL01"}, {"molecule_synonym": "Neogama", "syn_type": "TRADE_NAME", "synonyms": "NEOGAMA"}, {"molecule_synonym": "NSC-757850", "syn_type": "RESEARCH_CODE", "synonyms": "NSC-757850"}, {"molecule_synonym": "Omperan", "syn_type": "TRADE_NAME", "synonyms": "OMPERAN"}, {"molecule_synonym": "Pyrikappl", "syn_type": "TRADE_NAME", "synonyms": "PYRIKAPPL"}, {"molecule_synonym": "RD-1403", "syn_type": "RESEARCH_CODE", "synonyms": "RD-1403"}, {"molecule_synonym": "Sernevin", "syn_type": "TRADE_NAME", "synonyms": "SERNEVIN"}, {"molecule_synonym": "Splotin", "syn_type": "TRADE_NAME", "synonyms": "SPLOTIN"}, {"molecule_synonym": "Sulpirida", "syn_type": "INN_SPANISH", "synonyms": "SULPIRIDA"}, {"molecule_synonym": "Sulpiride", "syn_type": "ATC", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpiride", "syn_type": "BAN", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpiride", "syn_type": "BNF", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpiride", "syn_type": "INN", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpiride", "syn_type": "JAN", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpiride", "syn_type": "MERCK_INDEX", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpiride", "syn_type": "OTHER", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpiride", "syn_type": "USAN", "synonyms": "SULPIRIDE"}, {"molecule_synonym": "Sulpitil", "syn_type": "TRADE_NAME", "synonyms": "SULPITIL"}, {"molecule_synonym": "Sulpor", "syn_type": "TRADE_NAME", "synonyms": "SULPOR"}, {"molecule_synonym": "Sursumid", "syn_type": "TRADE_NAME", "synonyms": "SURSUMID"}, {"molecule_synonym": "Synedil", "syn_type": "TRADE_NAME", "synonyms": "SYNEDIL"}, {"molecule_synonym": "Trilan", "syn_type": "TRADE_NAME", "synonyms": "TRILAN"}], "molecule_type": "Small molecule", "natural_product": 1, "oral": true, "orphan": 0, "parenteral": false, "polymer_flag": 0, "pref_name": "SULPIRIDE", "prodrug": 0, "structure_type": "MOL", "therapeutic_flag": true, "topical": false, "usan_stem": null, "usan_stem_definition": null, "usan_substem": null, "usan_year": 1968, "veterinary": 0, "withdrawn_flag": false}], "page_meta": {"limit": 20, "next": null, "offset": 0, "previous": null, "total_count": 1}}