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Compound Detail

CHEMBL461522

METAMIZOLE
💊 Approved Drug
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💊 Approved Drug
Cc1c(N(C)CS(=O)(=O)O)c(=O)n(-c2ccccc2)n1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL461522
Name METAMIZOLE
Phase Approved
Structure Type MOL
InChI Key LVWZTYCIRDMTEY-UHFFFAOYSA-N

Known Names

Dipyrone free acid anhydrous Metamizole Methamizole-
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
20
Publications
3
Known Names

Molecular Properties

311.4
MW (Da)
0.77
ALogP
6
HBA
1
HBD
84.5
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Withdrawn
Chirality Achiral

Flags

Withdrawn Natural Product
USAN Year 1962

Extended Properties

Molecular Formula C13H17N3O4S
MW 311.36
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.65

Literature References

PubMed DOI Target Context # Activities
32932211 10.1016/j.ejmech.2020.112768 Rattus norvegicus 3
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 2
26116178 10.1016/j.bmc.2015.06.029 Mus musculus 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 2
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 2
37468498 10.1038/s41467-023-40064-9 Sodium-dependent dopamine transporter 1
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 1A 1
37468498 10.1038/s41467-023-40064-9 Amine oxidase [flavin-containing] A 1
37468498 10.1038/s41467-023-40064-9 Alpha-2A adrenergic receptor 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent serotonin transporter 1
37468498 10.1038/s41467-023-40064-9 Sodium-dependent noradrenaline transporter 1
37468498 10.1038/s41467-023-40064-9 Acetylcholinesterase 1
37468498 10.1038/s41467-023-40064-9 Estrogen receptor 1
18834112 10.1021/jm800656v Amine oxidase [flavin-containing] A 1
37468498 10.1038/s41467-023-40064-9 D(1A) dopamine receptor 1
- 10.1101/2020.04.21.054387 SARS-CoV-2 1
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1

Data from ChEMBL 36 via Core Engine