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

CHEMBL155223

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
COC(=O)Nc1nc2cc(C(=O)NC(C)C)ccc2[nH]1

Basic Information

ChEMBL ID CHEMBL155223
Phase Preclinical
Structure Type MOL
InChI Key QHXKBQYFISVRSP-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

276.3
MW (Da)
1.88
ALogP
4
HBA
3
HBD
96.1
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H16N4O3
MW 276.30
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -1.40

Activity Summary

IC50 2 meas. best 5.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Homo sapiens
CHEMBL372
IC50 5.8 5.8 1600.0 1
L1210
CHEMBL386
IC50 5.7 5.7 2000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
1738146 10.1021/jm00081a016 Brugia pahangi 5
1738146 10.1021/jm00081a016 L1210 2
1738146 10.1021/jm00081a016 Homo sapiens 2
1738146 10.1021/jm00081a016 Acanthocheilonema viteae 1

Data from ChEMBL 36 via Core Engine