General
Preferred name
AES-103
Synonyms
2,5-Furandimethanol ()
2,5-Bis(hydroxymethyl)furan ()
25-Furandimethanol ()
5-(Hydroxymethyl)furfuryl Alcohol ()
P&D ID
PD053824
CAS
1883-75-6
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 2,5-Furandimethanol is obtained from 5-Hydroxymethylfurfural. 5-hydroxymethylfurfural, as a building block, is considered an important intermediate due to its rich chemistry and potential availability from carbohydrates such as fructose, glucose, sucrose, cellulose and inulin[1][2].
Compound Sets
7
Cayman Chemical Bioactives
20658
CZ-OPENSCREEN Bioactive Library
Drug Repurposing Hub
JUMP-Target 1 Compound Set
74663
MedChem Express Bioactive Compound Library
HY-W017782
ReFrame library
Selleckchem Bioactive Compound Library
2-5-furandimethanol
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
128.05
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
1
Aromatic Ring Count
1
cLogP
0.26
TPSA
53.6
Fraction CSP3
0.33
Chiral centers
0.0
Largest ring
5.0
QED
0.6
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
HBB
Drug intermediate
MOA
hemoglobin modulator
Source data