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Compound Detail

CHEMBL3924088

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O=C(Nc1ccccc1)N1CCN(Cc2ccc3ccccc3c2O)CC1

Basic Information

ChEMBL ID CHEMBL3924088
Phase Preclinical
Structure Type MOL
InChI Key NUDOOCWDDHYJIC-UHFFFAOYSA-N
1
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

361.4
MW (Da)
3.90
ALogP
3
HBA
2
HBD
55.8
PSA (Ų)
0.74
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 C22H23N3O2
MW 361.45
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.27

Activity Summary

IC50 6 meas. best 7.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fatty-acid amide hydrolase 1
CHEMBL2243
IC50 7.8 7.5933 16.0 6

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine