{"ymdb_id":"YMDB01683","created_at":"2011-08-31T03:35:21.000Z","updated_at":"2016-09-08T18:36:59.000Z","name":"Ethanthiol","cas":null,"state":"Liquid","melting_point":"-147.8 oC","description":"Ethanthiol is a compound responsible for garlic-like or onion-like aromas in spoiled wines.","experimental_water_solubility":"15.6 mg/mL at 25 oC [WAKITA,K et al. (1986)]","experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":"6343","cs_id":"6103","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"ethanethiol","traditional_iupac":"ethanethiol","logp":"1.089600282","pka":null,"alogps_solubility":"1.05e+01 g/l","alogps_logp":"1.14","alogps_logs":"-0.77","acceptor_count":"0","donor_count":"1","rotatable_bond_count":"0","polar_surface_area":"0","refractivity":"19.0385","polarizability":"7.2530310229472","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-9.549918995117391","pka_strongest_acidic":"10.229032645424418","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"1","mddr_like_rule":"0","synonyms":["1-ethylthiol","1-Mercaptoethane","Aethanethiol","Aethylmercaptan","C2H5SH","Etantiolo","Ethaanthiol","Ethanethiol","Ethyl hydrosulfide","Ethyl mercaptan","Ethyl sulfhydrate","Ethyl thioalcohol","Ethylmercaptaan","Ethylmerkaptan","Etilmercaptano","Mercaptoethane","Thioethanol","Thioethyl alcohol"],"pathways":[],"growth_conditions":[],"references":[],"proteins":[]}