General
Preferred name
IDD388
Synonyms
IDD-388 ()
IDD 388 ()
(2-{[(4-BROMO-2-FLUOROBENZYL)AMINO]CARBONYL}-5-CHLOROPHENOXY)ACETIC ACID ()
P&D ID
PD005676
CAS
314297-26-2
Tags
drug candidate
available
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)
DESCRIPTION IDD388 is a selective aldose reductase (ALR2) inhibitor with an IC50 of 30 nM. IDD388 displays selectivity for ALR2 over ALR1 (IC50 of 14 ¦ÌM)[1].
PRICE 404
DESCRIPTION IDD388 is a selective and potent aldose reductase (ALR2) inhibitor with antitumor activity that inhibits the ALR1 receptor. (TargetMol Bioactive Compound Library)
Compound Sets
3
DrugBank
DB07028
MedChem Express Bioactive Compound Library
HY-121933
TargetMol Bioactive Compound Library
T27583
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
414.96
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
6
Ring Count
2
Aromatic Ring Count
2
cLogP
3.64
TPSA
75.63
Fraction CSP3
0.12
Chiral centers
0.0
Largest ring
6.0
QED
0.75
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Aldose Reductase
DNA/RNA Synthesis
Pathway
Metabolic Enzyme/Protease
Cell Cycle/Checkpoint
DNA Damage/DNA Repair
Source data