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Compound Detail

CHEMBL1958242

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Nc1ccc(S(=O)(=O)N/N=C/c2ccccc2[N+](=O)[O-])cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1958242
Phase Preclinical
Structure Type MOL
InChI Key WTLVWGZISQYGAK-OQLLNIDSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

320.3
MW (Da)
1.49
ALogP
6
HBA
2
HBD
127.7
PSA (Ų)
0.37
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H12N4O4S
MW 320.33
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.73

Literature References

PubMed DOI Target Context # Activities
22361685 10.1016/j.ejmech.2012.01.056 Human immunodeficiency virus type 1 reverse transcriptase 1

Data from ChEMBL 36 via Core Engine