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Compound Detail

CHEMBL1958450

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Cc1ccc(S(=O)(=O)N/N=C/c2cc(Cl)ccc2O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1958450
Phase Preclinical
Structure Type MOL
InChI Key BDJLZLNOWIAPEM-CXUHLZMHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

324.8
MW (Da)
2.67
ALogP
4
HBA
2
HBD
78.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H13ClN2O3S
MW 324.79
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.58

Literature References

PubMed DOI Target Context # Activities
22361685 10.1016/j.ejmech.2012.01.056 Human immunodeficiency virus type 1 reverse transcriptase 2
25127462 10.1016/j.bmc.2014.07.022 Candida albicans 1
25127462 10.1016/j.bmc.2014.07.022 Nakaseomyces glabratus 1

Data from ChEMBL 36 via Core Engine