General
Preferred name
p-ANISIC ACID
Synonyms
Draconic Acid ()
4-Anisic Acid ()
4-Methoxybenzoic acid ()
P-Methoxybenzoic Acid ()
4-Methoxy-Benzoic Acid ()
4-Methoxybenzoate ()
P&D ID
PD007634
CAS
100-09-4
1335-08-6
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
Drug Status
experimental
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
5
DrugBank
DB02795
DrugMAP
DM8HWS9
MedChem Express Bioactive Compound Library
HY-N1394
TargetMol Bioactive Compound Library
TCS0862
The Spectrum Collection
External IDs
43
Properties
(calculated by RDKit )
Molecular Weight
152.05
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
2
Ring Count
1
Aromatic Ring Count
1
cLogP
1.39
TPSA
46.53
Fraction CSP3
0.12
Chiral centers
0.0
Largest ring
6.0
QED
0.7
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Immunology/Inflammation
Microbiology&virology
Anti-infection
Metabolic Enzyme/Protease
Target
Antibacterial
Bacterial
Endogenous Metabolite
Source data