General
Preferred name
PD008008
Synonyms
4-Methylumbelliferyl-¦Â-D-glucuronide hydrate ()
4-Methylumbelliferyl-??D-glucuronide hydrate ()
?4-Methylumbelliferyl-?-D-glucuronide (hydrate) ()
P&D ID
PD008008
CAS
30138-68-2
Tags
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
2
Cayman Chemical Bioactives
Other bioactive compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
46
Properties
(calculated by RDKit )
Molecular Weight
352.08
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
4
Rotatable Bonds
3
Ring Count
3
Aromatic Ring Count
2
cLogP
-0.63
TPSA
146.66
Fraction CSP3
0.38
Chiral centers
5.0
Largest ring
6.0
QED
0.53
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
