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
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
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)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
Tocris Bioactive Compound Library
Tocriscreen Total
[[ a.name ]]
[[ ligand_id ]]
free of charge
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