General
Preferred name
PD103285
Synonyms
6-Hydroxybentazon ()
6-Hydroxybentazone ()
P&D ID
PD103285
CAS
60374-42-7
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 6-Hydroxybentazon is a phase I metabolite of bentazone, and bentazone is a chemical for use in herbicides.
Compound Sets
1
MedChem Express Bioactive Compound Library
External IDs
10
Properties
(calculated by RDKit )
Molecular Weight
256.05
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
2
Aromatic Ring Count
1
cLogP
0.91
TPSA
86.71
Fraction CSP3
0.3
Chiral centers
0.0
Largest ring
6.0
QED
0.73
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Drug Metabolite
Source data