General
Preferred name
PD132993
Synonyms
P&D ID
PD132993
Tags
natural product
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()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
1
Drug Repurposing Hub
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
3
Properties
(calculated by RDKit )
Molecular Weight
382.98
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
3
Rotatable Bonds
5
Ring Count
2
Aromatic Ring Count
1
cLogP
0.94
TPSA
118.36
Fraction CSP3
0.27
Chiral centers
1.0
Largest ring
6.0
QED
0.51
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Indication
hypertension
MOA
diuretic
Source data
