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Compound Detail

CHEMBL610753

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Cc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)no1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL610753
Phase Preclinical
Structure Type MOL
InChI Key XHJLDAHBWWMCRZ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

283.3
MW (Da)
1.69
ALogP
6
HBA
1
HBD
115.3
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 C10H9N3O5S
MW 283.27
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -2.49

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
27390065 10.1016/j.bmcl.2016.06.081 ADMET 7
27390065 10.1016/j.bmcl.2016.06.081 Staphylococcus saprophyticus 3
19811921 10.1016/j.bmc.2009.09.030 Leishmania infantum 2
27390065 10.1016/j.bmcl.2016.06.081 Unchecked 2
19811921 10.1016/j.bmc.2009.09.030 J774 1

Data from ChEMBL 36 via Core Engine