Structure

InChI Key PQMSFAORUFMASU-UHFFFAOYSA-M
Smile CC(=O)[N-]S(=O)(=O)c1ccc(N)cc1.[Na+]
InChI
InChI=1S/C8H10N2O3S.Na/c1-6(11)10-14(12,13)8-4-2-7(9)3-5-8;/h2-5H,9H2,1H3,(H,10,11);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H11N2NaO4S
Molecular Weight 254.24
AlogP 0.09
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 89.26
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 14.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial dihydropteroate synthase inhibitor KEGG PubMed PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Acne Vulgaris 4 D000152 FDA

Related Entries

Mixture
Mixture
Mixture

Adverse Reactions

System Organ Classification (SOC)
Relative Frequency (%)
Immune system disorders
36.11
Skin and subcutaneous tissue disorders
11.56
Eye disorders
10.75
Injury, poisoning and procedural complications
9.94
General disorders and administration site conditions
9.74
Respiratory, thoracic and mediastinal disorders
4.26
Cardiac disorders
3.65
Nervous system disorders
3.65
Infections and infestations
2.64

Cross References

Resources Reference
ChEBI 63858
ChEMBL CHEMBL1723241
EPA CompTox DTXSID50211129
FDA SRS 4NRT660KJQ
PubChem 6419954