General
Preferred name
PD005218
Synonyms
7,8-dihydroxy-4-phenyl-2H-chromen-2-one ()
7,8-Dihydroxy-4-phenylcoumarin ()
4-Phenyl-7,8-dihydroxycoumarin ()
P&D ID
PD005218
CAS
842-01-3
Tags
available
drug candidate
Drug indication
Discovery agent
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 4-Phenyl-7,8-dihydroxycoumarin is a coumarin derivative and can be used for bronchiectasiss research[1].
PRICE 38
DESCRIPTION 7,8-Dihydroxy-4-phenylcoumarin is active against catalytic activity of Human Immunodeficiency Virus type 1 integrase. It also inhibits Serine/threonine-protein kinase Sgk2. (Enamine Bioactive Compounds)
DESCRIPTION 4-Phenyl-7,8-dihydroxycoumarin (7,8-Dihydroxy-4-phenylcoumarin) inhibits the activity of Staphylococcus aureus DNA helicase (TargetMol Bioactive Compound Library)
Cell lines
2
Organisms
0
Compound Sets
6
DrugBank
DB08049
DrugMAP
DMUB5E8
Enamine Bioactive Compounds
EBC-47377
MedChem Express Bioactive Compound Library
HY-128410
Selleckchem Bioactive Compound Library
7-8-dihydroxy-4-phenylcoumarin
TargetMol Bioactive Compound Library
TJS0368
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
254.06
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
3
cLogP
2.87
TPSA
70.67
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.52
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
COMT
Pathway
Metabolic Enzyme/Protease
Neuronal Signaling
Source data