General
Preferred name
Dehydro Nifedipine
Synonyms
BAY-b 4759 ()
Dehydronifedipine ()
Nifedipine hydrochloride ()
P&D ID
PD039364
CAS
67035-22-7
2825006-69-5
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Dehydro nifedipine (BAY-b 4759) is a metabolite of Nifedipine (HY-B0284). Nifedipine (BAY-a-1040) is a potent calcium channel blocker and an agent of choice for cardiac insufficiencies[1].
PRICE 116
DESCRIPTION Dehydro Nifedipine (BAY-b 4759) is the main metabolite of nifedipine in human plasma. Dehydro Nifedipine inhibits glucose uptake in PC-12 cells with an IC50 value of 130 ??M. Nifedipine is a calcium channel blocker used in the treatment of hypertension and angina. Dehydronifedipine is formed when it is metabolized by cytochrome P450 (CYP) isomers CYP3A4 and CYP3A5.
DESCRIPTION Dehydro Nifedipine (BAY-b 4759) is the main metabolite of nifedipine in human plasma. Dehydro Nifedipine inhibits glucose uptake in PC-12 cells with an IC50 value of 130 μM. Nifedipine is a calcium channel blocker used in the treatment of hypertension and angina. Dehydronifedipine is formed when it is metabolized by cytochrome P450 (CYP) isomers CYP3A4 and CYP3A5. (TargetMol Bioactive Compound Library)
DESCRIPTION Nifedipine is a calcium channel blocker medication. It is used to manage angina, high blood pressure, Raynaud's phenomenon, and premature labor. (Enamine Bioactive Compounds)
Compound Sets
5
Cayman Chemical Bioactives
Enamine Bioactive Compounds
Enamine BioReference Compounds
MedChem Express Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
344.1
Hydrogen Bond Acceptors
7
Hydrogen Bond Donors
0
Rotatable Bonds
4
Ring Count
2
Aromatic Ring Count
2
cLogP
2.85
TPSA
108.63
Fraction CSP3
0.24
Chiral centers
0.0
Largest ring
6.0
QED
0.48
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Calcium Channel
Drug Metabolite
Pathway
Metabolism
Metabolic Enzyme/Protease
Source data