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Compound Detail

CHEMBL157196

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CCCCCCCCC(=O)CC(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL157196
Phase Preclinical
Structure Type MOL
InChI Key PGCYJKDJSLVDGX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

198.3
MW (Da)
3.29
ALogP
2
HBA
0
HBD
34.1
PSA (Ų)
0.42
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H22O2
MW 198.31
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 1.01

Literature References

PubMed DOI Target Context # Activities
9871570 10.1016/s0960-894x(98)00073-0 Fatty-acid amide hydrolase 1 2
9871570 10.1016/s0960-894x(98)00073-0 ADMET 1

Data from ChEMBL 36 via Core Engine