General
Preferred name
PD047827
Synonyms
17alpha-hydroxypregnenolone ()
17a-Hydroxypregnenolone ()
17α-hydroxypregnenolone ()
17?-hydroxy Pregnenolone ()
P&D ID
PD047827
CAS
387-79-1
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
4
Cayman Chemical Bioactives
29181
DrugMAP
DMT2EPG
Guide to Pharmacology
5103
MedChem Express Bioactive Compound Library
HY-113263
External IDs
39
Properties
(calculated by RDKit )
Molecular Weight
332.24
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
4
Aromatic Ring Count
0
cLogP
3.63
TPSA
57.53
Fraction CSP3
0.86
Chiral centers
7.0
Largest ring
6.0
QED
0.72
Structural alerts
2
aggregator (Aggregator Advisor)
Aggregators
aggregator (ZINC)
Aggregators
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data