General
Preferred name
GENISTIN
Synonyms
Genistein 7-O-¦Â-D-glucopyranoside ()
Genistein 7-O-??-D-glucopyranoside ()
Genistoside ()
Genistine ()
Genistein 7-glucoside ()
Genistein glucoside ()
Genistein 7-O-??D-glucopyranoside ()
Genistin (Genistoside) ()
Genistein-7-glucoside ()
Genistein 7-O-β-D-glucopyranoside ()
P&D ID
PD019230
CAS
529-59-9
Tags
drug candidate
natural product
available
Drug indication
Rotavirus infections
Cancer
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
5
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
39
Properties
(calculated by RDKit )
Molecular Weight
432.11
Hydrogen Bond Acceptors
10
Hydrogen Bond Donors
6
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
3
cLogP
0.05
TPSA
170.05
Fraction CSP3
0.29
Chiral centers
5.0
Largest ring
6.0
QED
0.33
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Apoptosis
Vitamin D Related/Nuclear Receptor
Target
Estrogen Receptor/ERR
Source data
