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Compound Detail

CHEMBL1999714

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Cc1ccc2c(c1)NC(=O)c1ccccc1N2

Basic Information

ChEMBL ID CHEMBL1999714
Phase Preclinical
Structure Type MOL
InChI Key UNPJSGSIMWLTCH-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

224.3
MW (Da)
3.30
ALogP
2
HBA
2
HBD
41.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H12N2O
MW 224.26
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -0.58

Activity Summary

Ki 1 meas. best 7.4

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Casein kinase I isoform gamma-1
CHEMBL2426
Ki 7.4 7.4 39.8 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine