General
Preferred name
KSD 2405
Synonyms
3-Hydroxybenzyl alcohol ()
P&D ID
PD054518
CAS
620-24-6
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 KSD 2405 is an endogenous metabolite.
PRICE 29
DESCRIPTION KSD 2405 (3-Hydroxybenzyl alcohol) is a hydroxybenzyl alcohol that is phenol substituted at position C-3 by a hydroxymethyl group. It is a pink or beige to brown crystalline powder, soluble in water.
Cell lines
0
Organisms
1
Compound Sets
2
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
124.05
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
0.88
TPSA
40.46
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
6.0
QED
0.58
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
Pathway
Metabolic Enzyme/Protease
Source data