General
Preferred name
Methyl alpha-D-mannoside
Synonyms
Methyl ??-D-mannopyranoside ()
Methyl α-D-mannopyranoside ()
α-Methyl-D-mannoside ()
Methyl ¦Á-D-mannopyranoside ()
P&D ID
PD008249
CAS
25281-48-5
617-04-9
Tags
drug candidate
natural product
available
Drug Status
experimental
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
3
DrugBank
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
194.08
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
4
Rotatable Bonds
2
Ring Count
1
Aromatic Ring Count
0
cLogP
-2.57
TPSA
99.38
Fraction CSP3
1.0
Chiral centers
5.0
Largest ring
6.0
QED
0.39
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Target
Bacterial
Source data
