General
Preferred name
Scyllo-inositol
Synonyms
Scyllitol ()
Scyllitol, Cocositol, Quercinitol, AZD 103, scyllo-Cyclohexanehexol ()
scyllo-inositol ()
ELND005 ()
Inositol, scyllo- ()
Scyllo-cyclohexanehexol ()
Cocositol ()
Cyclohexane-1,2,3,4,5,6-hexaol ()
Quercinitol ()
ELND-005 ()
AZD-103 ()
P&D ID
PD007379
CAS
488-59-5
Tags
available
drug candidate
Drug Status
investigational
Max Phase
2.0
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION PubChem CID 892 shows the non-chiral inositol structure (GtoPdb)
Compound Sets
12
Cayman Chemical Bioactives
31214
ChEMBL Drugs
CHEMBL468154
Concise Guide to Pharmacology 2017/18
4649
Concise Guide to Pharmacology 2019/20
4649
Concise Guide to Pharmacology 2021/22
4649
Concise Guide to Pharmacology 2023/24
4649
DrugBank
DB03106
Guide to Pharmacology
4649
MedChem Express Bioactive Compound Library
HY-W010041
ReFrame library
Selleckchem Bioactive Compound Library
scyllo-inositol
TargetMol Bioactive Compound Library
T8012
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
180.06
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
6
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
0
cLogP
-3.83
TPSA
121.38
Fraction CSP3
1.0
Chiral centers
0.0
Largest ring
6.0
QED
0.23
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Amyloid-¦Â
Amyloid-??
Amyloid-β
Endogenous Metabolite
Pathway
Neuroscience
Metabolic Enzyme/Protease
Neuronal Signaling
Source data