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Compound Detail

CHEMBL3222183

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Cn1ccc2cc(-c3ccc4oc(Nc5ccncc5)nc4c3)ccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3222183
Phase Preclinical
Structure Type MOL
InChI Key KLIJMIQWFKBBKO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

340.4
MW (Da)
5.13
ALogP
5
HBA
1
HBD
55.9
PSA (Ų)
0.49
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H16N4O
MW 340.39
Aromatic Rings 5
Heavy Atoms 26
NP-Likeness -1.21

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C2MD00307D Fatty-acid amide hydrolase 1 1

Data from ChEMBL 36 via Core Engine