1.0 2016-05-22 03:47:26 UTC 2026-08-21 23:00:21 UTC Tolterodine SmallMolecule Tolterodine is an organic compound with the chemical formula C22H31NO and an average molecular weight of 325.49 g/mol. Tolterodine belongs to the diphenylmethanes, a subclass of benzene and substituted derivatives within the organic compounds. It is classified under the superclass of benzenoids. This compound is found in or released from one recorded source: healthcare, pharmaceuticals & veterinary products, specifically urologicals. The recorded route of exposure for this substance is oral. Tolterodine acts upon five recorded protein targets. It functions as an antagonist of the Muscarinic acetylcholine receptor M1 (CHRM1), Muscarinic acetylcholine receptor M2 (CHRM2), Muscarinic acetylcholine receptor M3 (CHRM3), and Muscarinic acetylcholine receptor M4 (CHRM4), in addition to one other protein. C22H31NO 325.4876 325.240564619 2-[(1R)-3-[bis(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol (+)-tolterodine 124937-51-5 CC(C)N(CC[C@H](C1=CC=CC=C1)C1=C(O)C=CC(C)=C1)C(C)C InChI=1S/C22H31NO/c1-16(2)23(17(3)4)14-13-20(19-9-7-6-8-10-19)21-15-18(5)11-12-22(21)24/h6-12,15-17,20,24H,13-14H2,1-5H3/t20-/m1/s1 OOGJQPCLVADCPB-HXUWFJFHSA-N Organic compounds Benzenoids Benzene and substituted derivatives Diphenylmethanes Diphenylmethanes 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Hydrocarbon derivatives Organooxygen compounds Organopnictogen compounds Para cresols Toluenes Trialkylamines 1-hydroxy-2-unsubstituted benzenoid Amine Aralkylamine Aromatic homomonocyclic compound Diphenylmethane Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound P-cresol Phenol Tertiary aliphatic amine Tertiary amine Toluene Aromatic homomonocyclic compounds tertiary amine Detected and Not Quantified Tolterodine Action Pathway SMP0126381 Tolterodine Drug Metabolism Action Pathway SMP0143464 logp 5.12 logp 5.39 ALOGPS logs -4.78 ALOGPS solubility 5.34e-03 g/l ALOGPS logp 5.12 ChemAxon pka_strongest_acidic 10.28 ChemAxon pka_strongest_basic 11.01 ChemAxon iupac 2-[(1R)-3-[bis(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol ChemAxon average_mass 325.4876 ChemAxon mono_mass 325.240564619 ChemAxon smiles CC(C)N(CC[C@H](C1=CC=CC=C1)C1=C(O)C=CC(C)=C1)C(C)C ChemAxon formula C22H31NO ChemAxon inchi InChI=1S/C22H31NO/c1-16(2)23(17(3)4)14-13-20(19-9-7-6-8-10-19)21-15-18(5)11-12-22(21)24/h6-12,15-17,20,24H,13-14H2,1-5H3/t20-/m1/s1 ChemAxon inchikey OOGJQPCLVADCPB-HXUWFJFHSA-N ChemAxon polar_surface_area 23.47 ChemAxon refractivity 103.96 ChemAxon polarizability 39.27 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7227024608> DB01036 60774 54771 BE0000092 BE0000560 BE0000045 BE0000405 BE0000247