General
Preferred name
ORCINOL
Synonyms
5-Methylresorcinol ()
3,5-ToluenediolOrcin ()
5-Methyl-1,3-benzenediol ()
3,5-Dihydroxytoluene ()
Orcin ()
5-Methylresorcin ()
Orcinol monohydrate ()
5-Methylresorcinol monohydrate ()
Oricinol ()
5-Methyl Resorcinol ()
P&D ID
PD065281
CAS
504-15-4
6153-39-5
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 ]]
Cell lines
0
Organisms
2
Compound Sets
4
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
37
Properties
(calculated by RDKit )
Molecular Weight
124.05
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
1
cLogP
1.41
TPSA
40.46
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
6.0
QED
0.55
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Tyrosinase
Source data
