General
Preferred name
UNOPROSTONE
Synonyms
P&D ID
PD016158
CAS
120373-36-6
Tags
natural product
drug
available
Drug Status
investigational
approved
withdrawn
Drug indication
Glaucoma/ocular hypertension
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)
METABOLISM
After ocular application, unoprostone isopropyl is hydrolyzed by esterases in the cornea to its biological active metabolite, unoprostone free acid. ; Unoprostone free acid is then metabolized to several inactive metabolites with lower molecular weight and increased polarity via ε- or β-oxidation. ; No secondary conjugation is found and no significant effect on hepatic microsomal enzyme activity has been observed.
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
8
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
20
Molecular Weight
382.27
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
3
Rotatable Bonds
15
Ring Count
1
Aromatic Ring Count
0
cLogP
4.26
TPSA
94.83
Fraction CSP3
0.82
Chiral centers
4.0
Largest ring
5.0
QED
0.29
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
ATC
S01EE02
Source data
