General
Preferred name
Nor-BNI
Synonyms
P&D ID
PD094092
CAS
105618-26-6
Tags
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
1
Ki Database
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
4
Properties
(calculated by RDKit )
Molecular Weight
661.32
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
5
Rotatable Bonds
2
Ring Count
15
Aromatic Ring Count
3
cLogP
3.82
TPSA
121.65
Fraction CSP3
0.6
Chiral centers
10.0
Largest ring
8.0
QED
0.28
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
