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Compound Detail

CHEMBL1565221

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Cc1ccc(C2=NOC(=O)/C2=C\C=C\c2ccccc2)cc1

Basic Information

ChEMBL ID CHEMBL1565221
Phase Preclinical
Structure Type MOL
InChI Key OCPXVDAZLOMXLU-WIXUPIFPSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

289.3
MW (Da)
3.90
ALogP
3
HBA
0
HBD
38.7
PSA (Ų)
0.63
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 C19H15NO2
MW 289.33
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.37

Activity Summary

IC50 2 meas. best 5.95

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
1-acylglycerol-3-phosphate O-acyltransferase ABHD5/Perilipin-5
CHEMBL3885501
IC50 5.95 5.95 1123.0 1
Perilipin-1/ABHD5
CHEMBL3883313
IC50 5.91 5.91 1227.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine