General
Preferred name
PD050577
Synonyms
22R-hydroxycholesterol ()
22(R)-HYDROXYCHOLESTEROL ()
22(R)-hydroxy Cholesterol ()
P&D ID
PD050577
CAS
17954-98-2
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
8
Cayman Chemical Bioactives
89355
Concise Guide to Pharmacology 2017/18
2742
Concise Guide to Pharmacology 2019/20
2742
Concise Guide to Pharmacology 2021/22
2742
Concise Guide to Pharmacology 2023/24
2742
DrugMAP
DME8273
Guide to Pharmacology
2742
ReFrame library
External IDs
28
Properties
(calculated by RDKit )
Molecular Weight
402.35
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
5
Ring Count
4
Aromatic Ring Count
0
cLogP
6.36
TPSA
40.46
Fraction CSP3
0.93
Chiral centers
9.0
Largest ring
6.0
QED
0.53
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data