1.0 2016-05-25 03:24:39 UTC 2026-08-19 15:21:12 UTC Clopidogrel SmallMolecule Clopidogrel is an organic compound with the formula C16H16ClNO2S and an average molecular weight of 321.82 g/mol. Clopidogrel belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It acts as an antagonist of the P2Y purinoceptor 12 (P2RY12) protein target. The compound is utilized as an antithrombotic agent and is found in or released from ten recorded sources. These include healthcare, pharmaceuticals & veterinary products; drinking water & water supply (drinking water); food, food processing & cookware (preparation of wine or sparkling wine); household cleaning & consumer products (cigar cigarettes, non electric simulated smoking devices, and other smoking requisites); and electrical & electronic equipment (antennas, electrically stimulated smoking devices, magnets, and television systems). The recorded exposure route for clopidogrel is oral. In terms of health effects, clopidogrel is used as a treatment for acute myocardial infarction (PMC3291088), thrombosis (PMC9368651), stroke (PMC6044138, PMC9259378), and ischemic stroke (PMC3148418, PMC8084398, PMC9368651). Additionally, it has a therapeutic effect on thrombosis (PMC11124379) and stroke (PMC3148418). C16H16ClNO2S 321.822 321.059027158 methyl (2S)-2-(2-chlorophenyl)-2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetate clopidogrel 113665-84-2 [H][C@@](N1CCC2=C(C1)C=CS2)(C(=O)OC)C1=CC=CC=C1Cl InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1 GKTWGGQPFAXNFI-HNNXBMFYSA-N Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Alpha amino acid esters Aralkylamines Aryl chlorides Azacyclic compounds Carbonyl compounds Chlorobenzenes Heteroaromatic compounds Hydrocarbon derivatives Methyl esters Monocarboxylic acids and derivatives Organic oxides Organochlorides Organopnictogen compounds Pyridines and derivatives Thienopyridines Thiophenes Trialkylamines Alpha-amino acid ester Amine Aralkylamine Aromatic heteropolycyclic compound Aryl chloride Aryl halide Azacycle Benzenoid Carbonyl group Carboxylic acid ester Chlorobenzene Halobenzene Heteroaromatic compound Hydrocarbon derivative Methyl ester Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organochloride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Pyridine Tertiary aliphatic amine Tertiary amine Thienopyridine Thiophene Aromatic heteropolycyclic compounds methyl ester monochlorobenzenes thienopyridine Detected and Not Quantified Clopidogrel Action Pathway SMP0000260 Clopidogrel Metabolism Pathway SMP0000610 Clopidogrel Action Pathway (new) SMP0126460 Clopidogrel Drug Metabolism Action Pathway SMP0143201 logp 4.03 logp 3.84 ALOGPS logs -4.43 ALOGPS solubility 1.18e-02 g/l ALOGPS logp 4.03 ChemAxon pka_strongest_basic 5.14 ChemAxon iupac methyl (2S)-2-(2-chlorophenyl)-2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetate ChemAxon average_mass 321.822 ChemAxon mono_mass 321.059027158 ChemAxon smiles [H][C@@](N1CCC2=C(C1)C=CS2)(C(=O)OC)C1=CC=CC=C1Cl ChemAxon formula C16H16ClNO2S ChemAxon inchi InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1 ChemAxon inchikey GKTWGGQPFAXNFI-HNNXBMFYSA-N ChemAxon polar_surface_area 29.54 ChemAxon refractivity 84.93 ChemAxon polarizability 33.19 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f722625aa18> DB00758 60606 BE0000110