Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR0202)
Drug Name
Bepridil hydrochloride
Synonyms
Bepridil HCl; EINECS 268-472-2; MLS000028456; N-Benzyl-beta-((2-methylpropoxy)methyl)-N-phenylpyrrolidine-1-ethylamine monohydrochloride; N-benzyl-N-(3-isobutoxy-2-pyrrolidin-1-yl-propyl)aniline hydrochloride; Opera_ID_594; Prestwick_697; SMR000058419; SR-01000075304; 1-Isobutoxy-2-pyrrolidino-3-(N-benzylanilino)propane hydrochloride; 1-Pyrrolidineethanamine, beta-((2-methylpropoxy)methyl)-N-phenyl-N-(phenylmethyl)-, monohydrochloride; 1978CERM; 68099-86-5; 74764-40-2; AC1Q3DPT; BEPRIDIL HYDROCHLORIDE; CHEBI:52712
Indication Angina pectoris [ICD11: BA40] Approved [1]
Structure
3D MOL is unavailable 2D MOL
Pharmaceutical Properties Molecular Weight 403 Topological Polar Surface Area 15.7
Heavy Atom Count 28 Rotatable Bond Count 10
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3
Cross-matching ID
PubChem CID
50088
ChEBI ID
CHEBI:52712
CAS Number
68099-86-5
TTD Drug ID
D0Y4JJ
Formula
C24H35ClN2O
Canonical SMILES
CC(C)COCC(CN(CC1=CC=CC=C1)C2=CC=CC=C2)N3CCCC3.Cl
InChI
1S/C24H34N2O.ClH/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22;/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3;1H
InChIKey
JXBBWYGMTNAYNM-UHFFFAOYSA-N
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 2D6 (CYP2D6) DME0009 Homo sapiens
CP2D6_HUMAN
1.14.14.1
[2]
Cytochrome P450 3A4 (CYP3A4) DME0001 Homo sapiens
CP3A4_HUMAN
1.14.14.55
[3]
References
1 Bepridil Hydrochloride was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Serum flecainide S/R ratio reflects the CYP2D6 genotype and changes in CYP2D6 activity. Drug Metab Pharmacokinet. 2015 Aug;30(4):257-62.
3 Integrated analysis on the physicochemical properties of dihydropyridine calcium channel blockers in grapefruit juice interactions. Curr Pharm Biotechnol. 2012 Jul;13(9):1705-17.

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