General
Preferred name
PYRITHIONE
Synonyms
NSC-179790 ()
Omadine ()
Omacide 24 ()
Sodium pyrithione ()
Pyrithione sodium salt ()
AL02725 ()
Tomicide s ()
Omadine sodium ()
NSC-4483 ()
AL-02725 ()
Topcide 280 ()
PYRITHIONE SODIUM ()
P&D ID
PD074260
CAS
1121-30-8
15922-78-8
Tags
available
drug
drug candidate
Drug Status
approved
Max Phase
4.0
First approval
1986
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
DrugMatrix
MedChem Express Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
41
Properties
(calculated by RDKit )
Molecular Weight
127.01
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
1
Aromatic Ring Count
1
cLogP
1.45
TPSA
25.16
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.42
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Target
Bacterial
Fungal
Source data
