General
Preferred name
1-Deoxymannojirimycin (hydrochloride)
Synonyms
1-Deoxymannojirimycin hydrochloride ()
1-Deoxymannojirimycin (hydrochloride) ()
P&D ID
PD017876
CAS
73465-43-7
Tags
natural product
available
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 Adenosine deaminase inhibitor (Tocris Bioactive Compound Library)
DESCRIPTION α-Mannosidase I inhibitor (Tocriscreen Total)
Compound Sets
4
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
Tocris Bioactive Compound Library
Tocriscreen Total
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
199.06
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
5
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
0
cLogP
-2.54
TPSA
92.95
Fraction CSP3
1.0
Chiral centers
4.0
Largest ring
6.0
QED
0.32
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Primary Target
Glycosylases
MOA
Inhibitor
Pathway
Anti-infection
Target
HIV
Influenza Virus
Source data