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Compound Detail

CHEMBL3222170

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c1cc2cc(-c3ccc4oc(NC5CCCCC5)nc4c3)cnc2[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3222170
Phase Preclinical
Structure Type MOL
InChI Key SYPDDRWCHZSHKA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

332.4
MW (Da)
5.12
ALogP
4
HBA
2
HBD
66.7
PSA (Ų)
0.55
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 C20H20N4O
MW 332.41
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -0.88

Literature References

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

Data from ChEMBL 36 via Core Engine