General
Preferred name
NYMPHAEOL A
Synonyms
P&D ID
PD134524
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Cell lines
5
Organisms
0
Compound Sets
1
Probe Miner (suitable probes)
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
424.19
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
4
Rotatable Bonds
6
Ring Count
3
Aromatic Ring Count
2
cLogP
5.45
TPSA
107.22
Fraction CSP3
0.32
Chiral centers
1.0
Largest ring
6.0
QED
0.36
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data