{"atc_classifications": ["G01AA10", "D10AF01", "J01FF01"], "availability_type": 1, "biotherapeutic": null, "black_box_warning": 1, "chemical_probe": 0, "chirality": 1, "cross_references": [], "dosed_ingredient": false, "first_approval": 1970, "first_in_class": 0, "helm_notation": null, "inorganic_flag": 0, "max_phase": "4.0", "molecule_chembl_id": "CHEMBL1753", "molecule_hierarchy": {"active_chembl_id": "CHEMBL1753", "molecule_chembl_id": "CHEMBL1753", "parent_chembl_id": "CHEMBL1753"}, "molecule_properties": {"alogp": "0.39", "aromatic_rings": 0, "full_molformula": "C18H33ClN2O5S", "full_mwt": "424.99", "hba": 7, "hbd": 4, "heavy_atoms": 27, "mw_freebase": "424.99", "np_likeness_score": "0.60", "num_ro5_violations": 0, "psa": "102.26", "qed_weighted": "0.44", "ro3_pass": "N", "rtb": 7}, "molecule_structures": {"canonical_smiles": "CCC[C@@H]1C[C@@H](C(=O)N[C@@H]([C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)[C@H](C)Cl)N(C)C1", "molfile": "\n     RDKit          2D\n\n 29 30  0  0  0  0  0  0  0  0999 V2000\n  -10.1946    2.1455    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n  -10.8621    1.6606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  -10.6071    0.8760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -9.7821    0.8760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -9.5272    1.6606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -8.7426    1.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -8.5711    2.7225    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -8.1295    1.3635    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -7.3449    1.6184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -6.7318    1.0664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -7.1314    2.4153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -6.3345    2.6288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -7.7147    2.9987    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n   -6.9033    0.2594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -6.2902   -0.2926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -5.5056   -0.0377    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -5.3341    0.7692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -5.9472    1.3213    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.5494    1.0242    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.3779    1.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -4.8925   -0.5898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -6.4618   -1.0996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   -7.6879    0.0045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  -10.1946    2.9705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  -11.0921    0.2086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  -11.9171    0.2086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  -12.3296   -0.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -7.5287    0.8529    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0\n   -6.5480    1.8319    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0\n  1  2  1  0\n  2  3  1  0\n  3  4  1  0\n  4  5  1  0\n  1  5  1  0\n  5  6  1  6\n  6  7  2  0\n  6  8  1  0\n  8  9  1  0\n 10  9  1  0\n  9 11  1  0\n 11 12  1  0\n 11 13  1  1\n 10 14  1  0\n 18 10  1  0\n 14 15  1  0\n 15 16  1  0\n 16 17  1  0\n 17 18  1  0\n 17 19  1  6\n 19 20  1  0\n 16 21  1  6\n 15 22  1  1\n 14 23  1  1\n  1 24  1  0\n  3 25  1  1\n 25 26  1  0\n 26 27  1  0\n 10 28  1  6\n  9 29  1  1\nM  END\n> <chembl_id>\nCHEMBL1753\n\n> <chembl_pref_name>\nCLINDAMYCIN", "standard_inchi": "InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)/t9-,10+,11-,12+,13-,14+,15+,16+,18+/m0/s1", "standard_inchi_key": "KDLRVYVGXIQJDK-AWPVFWJPSA-N"}, "molecule_synonyms": [{"molecule_synonym": "7(s)-chloro-7-deoxylincomycin", "syn_type": "OTHER", "synonyms": "7(S)-CHLORO-7-DEOXYLINCOMYCIN"}, {"molecule_synonym": "Chlorodeoxylincomycin", "syn_type": "OTHER", "synonyms": "CHLORODEOXYLINCOMYCIN"}, {"molecule_synonym": "Chlorolincomycin", "syn_type": "OTHER", "synonyms": "CHLOROLINCOMYCIN"}, {"molecule_synonym": "Clindamicina", "syn_type": "INN_SPANISH", "synonyms": "CLINDAMICINA"}, {"molecule_synonym": "Clindamycin", "syn_type": "ATC", "synonyms": "CLINDAMYCIN"}, {"molecule_synonym": "Clindamycin", "syn_type": "BAN", "synonyms": "CLINDAMYCIN"}, {"molecule_synonym": "Clindamycin", "syn_type": "BNF", "synonyms": "CLINDAMYCIN"}, {"molecule_synonym": "Clindamycin", "syn_type": "INN", "synonyms": "CLINDAMYCIN"}, {"molecule_synonym": "Clindamycin", "syn_type": "MERCK_INDEX", "synonyms": "CLINDAMYCIN"}, {"molecule_synonym": "Clindamycin", "syn_type": "OTHER", "synonyms": "CLINDAMYCIN"}, {"molecule_synonym": "Clindamycin", "syn_type": "USAN", "synonyms": "CLINDAMYCIN"}, {"molecule_synonym": "Clindamycine", "syn_type": "INN_FRENCH", "synonyms": "CLINDAMYCINE"}, {"molecule_synonym": "U-21,251", "syn_type": "RESEARCH_CODE", "synonyms": "U-21,251"}, {"molecule_synonym": "U-21251", "syn_type": "RESEARCH_CODE", "synonyms": "U-21251"}], "molecule_type": "Small molecule", "natural_product": 1, "oral": true, "orphan": 0, "parenteral": false, "polymer_flag": 0, "pref_name": "CLINDAMYCIN", "prodrug": 0, "structure_type": "MOL", "therapeutic_flag": true, "topical": false, "usan_stem": "-mycin", "usan_stem_definition": "antibiotics (Streptomyces strain)", "usan_substem": "-mycin", "usan_year": 1968, "veterinary": 0, "withdrawn_flag": false}