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Compound Detail

CHEMBL1584597

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Cc1cccc(C)c1NC(=O)C(Cl)C(=O)c1ccccc1

Basic Information

ChEMBL ID CHEMBL1584597
Phase Preclinical
Structure Type MOL
InChI Key FPMBWSWPBUTVSU-UHFFFAOYSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

301.8
MW (Da)
3.73
ALogP
2
HBA
1
HBD
46.2
PSA (Ų)
0.53
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H16ClNO2
MW 301.77
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.74

Activity Summary

EC50 3 meas. best 6.11

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
General amino acid permease AGP1
CHEMBL1741178
EC50 6.11 6.11 781.0 1
Large ribosomal subunit protein eL19A
CHEMBL1741172
EC50 5.72 5.72 1902.0 1
Unchecked
CHEMBL612545
EC50 4.71 4.71 19300.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine