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

General Information of Drug (ID: DR3057)
Drug Name
Furnidipine
Synonyms Furaldipine; CRE-319
Indication Nerve injury [ICD11: ND56] Discontinued in Phase 3 [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 416.4 Topological Polar Surface Area 120
Heavy Atom Count 30 Rotatable Bond Count 7
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 8
Cross-matching ID
PubChem CID
65988
CAS Number
138661-03-7
TTD Drug ID
D0X9VP
Formula
C21H24N2O7
Canonical SMILES
CC1=C(C(C(=C(N1)C)C(=O)OCC2CCCO2)C3=CC=CC=C3[N+](=O)[O-])C(=O)OC
InChI
InChI=1S/C21H24N2O7/c1-12-17(20(24)28-3)19(15-8-4-5-9-16(15)23(26)27)18(13(2)22-12)21(25)30-11-14-7-6-10-29-14/h4-5,8-9,14,19,22H,6-7,10-11H2,1-3H3
InChIKey
GGVUNNUOJDGCBK-UHFFFAOYSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
Furnidipine M-2 DM002257
175469
Unclear - Unclear 1 [2] , [3]
Furnidipine M-3 DM015562
9909712
Unclear - Unclear 1 [2]
Furnidipine M-8 DM015841
13599653
Unclear - Unclear 1 [4]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR009739 Furnidipine Furnidipine M-2 Unclear - Unclear Unclear [2], [3]
MR009740 Furnidipine Furnidipine M-3 Unclear - Unclear Unclear [2]
MR009741 Furnidipine Furnidipine M-8 Unclear - Unclear Unclear [4]
References
1 Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800002558)
2 Dihydropyridines' metabolites-induced early apoptosis after myocardial infarction in rats; new outlook on preclinical study with M-2 and M-3
3 Cardioprotective effects of an active metabolite of furnidipine in 2 models of isolated heart and on in vivo ischemiaCinduced and reperfusion-induced arrhythmias in rats
4 Differential effects of furnidipines' metabolites on reperfusion-induced arrhythmias in rats in vivo

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