Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL510692

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C(O)c1cccc2c(Br)n[nH]c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL510692
Phase Preclinical
Structure Type MOL
InChI Key SHOGUOJFKMABOH-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

241.0
MW (Da)
2.02
ALogP
2
HBA
2
HBD
66.0
PSA (Ų)
0.80
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H5BrN2O2
MW 241.04
Aromatic Rings 2
Heavy Atoms 13
NP-Likeness -0.63

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
18502134 10.1016/j.bmc.2008.04.056 Nitric oxide synthase 1 2
18502134 10.1016/j.bmc.2008.04.056 Nitric oxide synthase 3 2
18502134 10.1016/j.bmc.2008.04.056 Nitric oxide synthase, inducible 1
18502134 10.1016/j.bmc.2008.04.056 RAW264.7 1

Data from ChEMBL 36 via Core Engine