General
Preferred name
ANISOLE
Synonyms
Methoxy-Benzeneanisole ()
P&D ID
PD088220
CAS
100-66-3
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()] ]]
Description
(extracted from source data)
DESCRIPTION
Anisole is a precursor to perfumes, insect pheromones, and pharmaceuticals. It has a role as a plant metabolite.
(Enamine Bioactive Compounds)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
1
Enamine Bioactive Compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
26
Molecular Weight
108.06
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
1.7
TPSA
9.23
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
6.0
QED
0.53
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
