General
Preferred name
PMID8709131C15
Synonyms
compound 15 [PMID: 8709131] ()
P&D ID
PD048674
CAS
150843-77-9
Tags
drug candidate
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
2
DrugMAP
Guide to Pharmacology
External IDs
9
Properties
(calculated by RDKit )
Molecular Weight
289.18
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
3
Ring Count
5
Aromatic Ring Count
2
cLogP
4.71
TPSA
3.24
Fraction CSP3
0.33
Chiral centers
1.0
Largest ring
6.0
QED
0.79
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data