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Compound Detail

CHEMBL5860853

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O=C(CCCCc1cccc(Cl)c1)N1CCOC1=O

Basic Information

ChEMBL ID CHEMBL5860853
Phase Preclinical
Structure Type MOL
InChI Key UAAKVCNHPOYSBG-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

281.7
MW (Da)
3.03
ALogP
3
HBA
0
HBD
46.6
PSA (Ų)
0.78
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H16ClNO3
MW 281.74
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -1.15

Activity Summary

IC50 1 meas. best 6.43

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
N-acylethanolamine-hydrolyzing acid amidase
CHEMBL4349
IC50 6.43 6.43 370.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine