General
Preferred name
HPGDS inhibitor 2
Synonyms
GSK-2894631A ()
P&D ID
PD054613
CAS
2101626-26-8
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 HPGDS inhibitor 2 is a highly potent and selective hematopoietic prostaglandin D synthase (H-PGDS) inhibitor with an IC50 of 9.9 nM[1].
PRICE 169
DESCRIPTION HPGDS inhibitor 2 (GSK-2894631A) is a potent, selective hematopoietic prostaglandin D synthase (h-pgds) inhibitor, IC50 = 9.9 nm. (TargetMol Bioactive Compound Library)
Cell lines
0
Organisms
1
Compound Sets
2
MedChem Express Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
8
Properties
(calculated by RDKit )
Molecular Weight
378.18
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
5
Ring Count
3
Aromatic Ring Count
2
cLogP
3.9
TPSA
71.45
Fraction CSP3
0.5
Chiral centers
0.0
Largest ring
6.0
QED
0.83
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
hPGDS
PGE synthase
Pathway
Immunology/Inflammation
Source data