General
Preferred name
Robinin
Synonyms
NSC 9222 ()
P&D ID
PD124215
CAS
301-19-9
81992-85-0
Tags
available
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
MedChem Express Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
740.22
Hydrogen Bond Acceptors
19
Hydrogen Bond Donors
11
Rotatable Bonds
8
Ring Count
6
Aromatic Ring Count
3
cLogP
-2.89
TPSA
308.12
Fraction CSP3
0.55
Chiral centers
15.0
Largest ring
6.0
QED
0.11
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Apoptosis
Immunology/Inflammation
Target
Toll-like Receptor (TLR)
Source data
