1.0 2016-05-22 05:25:23 UTC 2026-08-25 10:51:54 UTC Prothionamide SmallMolecule Prothionamide belongs to the pyridines and derivatives, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C9H12N2S and an average molecular weight of 180.27 g/mol. In terms of biological activity, one protein target has been recorded for prothionamide, as it acts as an inhibitor of Enoyl-[acyl-carrier-protein] reductase [NADH] (inhA). Prothionamide is found in or released from 36 recorded sources across several categories. Within the realm of electrical and electronic equipment, it is associated with amplifiers, antennas, coils, auxiliary devices, adjustable resistors, and 14 other items. In building and construction, it is linked to roofs, stairs and ramps, floors, fencing, ladders, and 3 additional sources. Its presence is also noted in household cleaning and consumer products, specifically in soap dispensers, tobacco product cases, tobacco pipes, pipe accessories, and other smoking requisites. Additionally, the compound is found in food, food processing, and cookware, including the processing of meats, the processing of fish, and the preparation of wine or sparkling wine. Finally, it is recorded as being found in household items, specifically badges. protionamide C9H12N2S 180.27 180.072119568 2-propylpyridine-4-carboimidothioic acid tuberex 14222-60-7 CCCC1=NC=CC(=C1)C(S)=N InChI=1S/C9H12N2S/c1-2-3-8-6-7(9(10)12)4-5-11-8/h4-6H,2-3H2,1H3,(H2,10,12) VRDIULHPQTYCLN-UHFFFAOYSA-N Organic compounds Organoheterocyclic compounds Pyridines and derivatives Pyridines and derivatives Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Thioamides Thiocarbonyl compounds Thiocarboxylic acid amides Aromatic heteromonocyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organonitrogen compound Organopnictogen compound Organosulfur compound Pyridine Thioamide Thiocarbonyl group Thiocarboxylic acid amide Aromatic heteromonocyclic compounds Detected and Not Quantified Protionamide Drug Metabolism Action Pathway SMP0144880 logp 1.77 logp 2.38 ALOGPS logs -3.26 ALOGPS solubility 9.83e-02 g/l ALOGPS logp 2.22 ChemAxon pka_strongest_basic 7.31 ChemAxon iupac 2-propylpyridine-4-carboimidothioic acid ChemAxon average_mass 180.27 ChemAxon mono_mass 180.072119568 ChemAxon smiles CCCC1=NC=CC(=C1)C(S)=N ChemAxon formula C9H12N2S ChemAxon inchi InChI=1S/C9H12N2S/c1-2-3-8-6-7(9(10)12)4-5-11-8/h4-6H,2-3H2,1H3,(H2,10,12) ChemAxon inchikey VRDIULHPQTYCLN-UHFFFAOYSA-N ChemAxon polar_surface_area 36.74 ChemAxon refractivity 63.86 ChemAxon polarizability 20.07 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bafe27588> DB12667 666418 579891 BE0000332