General
Preferred name
InsP6
Synonyms
Inositol hexaphosphate ()
Inositol polyphosphate ()
fytic acid ()
SNF472 ()
PHYTIC ACID ()
PHYTATE ()
P&D ID
PD056499
CAS
50762-79-3
83-86-3
34367-89-0
Tags
available
molecular glue
drug candidate
Drug indication
Calcific uremic arteriolopathy
Calciphylaxis
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 ]]
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
659.86
Hydrogen Bond Acceptors
12
Hydrogen Bond Donors
12
Rotatable Bonds
12
Ring Count
1
Aromatic Ring Count
0
cLogP
-3.13
TPSA
400.56
Fraction CSP3
1.0
Chiral centers
0.0
Largest ring
6.0
QED
0.09
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
MOA
Endogenous Metabolite
Xanthine Oxidase
Pathway
Metabolic Enzyme/Protease
Target
Xanthine oxidase
Source data
