General
Preferred name
SODIUM BENZOATE
Synonyms
Benzoic acid sodium salt ()
Microcare sb ()
E211 ()
Mthwsh ()
Fuminaru ()
INS NO.211 ()
FEMA NO. 3025 ()
Sobenate ()
Purox s ()
E-211 ()
INS-211 ()
Antimol ()
Amzoate ()
P&D ID
PD071656
CAS
532-32-1
Tags
available
drug
Drug Status
approved
Max Phase
Phase 4
Drug indication
Antihyperammonemic
Pharmaceutic Aid (antifungal agent)
First approval
1987
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
4
ChEMBL Approved Drugs
ChEMBL Drugs
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
144.02
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
-2.95
TPSA
40.13
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.4
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
D-Amino Acid Oxidase
Source data
