General
Preferred name
CIANIDOL
Synonyms
Catechin-(+,-) hydrate ()
(+)-Catechin Hydrate ()
CATECHIN ()
P&D ID
PD055503
CAS
18829-70-4
7295-85-4
225937-10-0
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)
PRICE 29
DESCRIPTION (+)-Catechin Hydrate is an antioxidant flavonoid of plant origin; a free radical scavenger, preventing free radical-mediated damage in a variety of biological systems. (TargetMol Bioactive Compound Library)
Compound Sets
2
DrugMatrix
TargetMol Bioactive Compound Library
External IDs
35
Properties
(calculated by RDKit )
Molecular Weight
290.08
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
5
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
2
cLogP
1.55
TPSA
110.38
Fraction CSP3
0.2
Chiral centers
2.0
Largest ring
6.0
QED
0.51
Structural alerts
1
Nonspecific/NOS
IMP
Nuisance compounds
Custom attributes
(extracted from source data)
Target
antioxidant
COX
COX-1
Pathway
Immunology/Inflammation
Neuroscience
oxidation-reduction
Source data