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

CHEMBL1235374

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
NCc1ccc([N+](=O)[O-])cc1

Basic Information

ChEMBL ID CHEMBL1235374
Phase Preclinical
Structure Type MOL
InChI Key ODVBBZFQPGORMJ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

152.2
MW (Da)
1.05
ALogP
3
HBA
1
HBD
69.2
PSA (Ų)
0.51
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H8N2O2
MW 152.15
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness -1.07

Activity Summary

IC50 1 meas. best 6.14

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Lysyl oxidase homolog 2
CHEMBL3714029
IC50 6.14 6.14 719.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
28435530 10.1021/acsmedchemlett.7b00014 Lysyl oxidase homolog 2 1

Data from ChEMBL 36 via Core Engine