General
Preferred name
CHOLIC ACID
Synonyms
P&D ID
PD056365
CAS
81-25-4
Tags
natural product
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
2
AdooQ Bioactive Compound Library
DrugMatrix
External IDs
24
Properties
(calculated by RDKit )
Molecular Weight
408.29
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
4
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
0
cLogP
3.45
TPSA
97.99
Fraction CSP3
0.96
Chiral centers
11.0
Largest ring
6.0
QED
0.57
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data