General
Preferred name
PD-128763
Synonyms
3,4-Dihydro-5-Methyl-Isoquinolinone ()
5-methyl-3,4-dihydroisoquinolin-1(2H)-one ()
P&D ID
PD007293
CAS
129075-56-5
Tags
available
drug candidate
Drug indication
Discovery agent
Drug Status
experimental
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
5-methyl-3,4-dihydroisoquinolin-1(2H)-one exhibits inhibitory activity against Poly (ADP-ribose) polymerase in rat H4 hepatoma cell. Also it is vasoprotective agent.
(Enamine Bioactive Compounds)
DESCRIPTION
PD-128763 is a selective inhibitor of poly(ADP-ribose) polymerase.
(BOC Sciences Bioactive Compounds)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
BOC Sciences Bioactive Compounds
DrugBank
DrugMAP
Enamine Bioactive Compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
21
Molecular Weight
161.08
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
2
Aromatic Ring Count
1
cLogP
1.28
TPSA
29.1
Fraction CSP3
0.3
Chiral centers
0.0
Largest ring
6.0
QED
0.61
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
