General
Preferred name
Hydrocinnamic acid
Synonyms
3-Phenylpropanoic acid ()
3-phenylpropionic acid ()
3-Phenyl-n-propionic acid ()
3-phenylpropionic acid, Benzylacetic acid ()
PHENYL PROPIONIC ACID ()
P&D ID
PD008213
CAS
501-52-0
Tags
available
drug candidate
Drug Status
experimental
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 29
DESCRIPTION Hydrocinnamic acid has inhibitory activity against carboxypeptidase A1 and phenylalanine 2-monooxygenase (Pseudomonas P501). (Enamine Bioactive Compounds)
DESCRIPTION Hydrocinnamic acid is an inter-root compound with growth-regulating activity. (TargetMol Bioactive Compound Library)
Compound Sets
5
DrugBank
DB02024
Enamine Bioactive Compounds
EBC-47334
MedChem Express Bioactive Compound Library
HY-Y1088
Selleckchem Bioactive Compound Library
hydrocinnamic-acid
TargetMol Bioactive Compound Library
T3731
External IDs
40
Properties
(calculated by RDKit )
Molecular Weight
150.07
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
3
Ring Count
1
Aromatic Ring Count
1
cLogP
1.7
TPSA
37.3
Fraction CSP3
0.22
Chiral centers
0.0
Largest ring
6.0
QED
0.71
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
Fungal
Pathway
Metabolism
Metabolic Enzyme/Protease
Source data