General
Preferred name
Isomaltose
Synonyms
D-Isomaltose ()
6-O-??-D-Glucopyranosyl-D-glucose ()
6-O-¦Á-D-Glucopyranosyl-D-glucose ()
P&D ID
PD055404
CAS
499-40-1
585-99-9
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
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
1
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
342.12
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
8
Rotatable Bonds
4
Ring Count
2
Aromatic Ring Count
0
cLogP
-5.4
TPSA
189.53
Fraction CSP3
1.0
Chiral centers
10.0
Largest ring
6.0
QED
0.24
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
