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Compound Detail

CHEMBL69198

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COc1ccc(C(=O)c2c(C)n(CC3CN(C)CCO3)c3ccccc23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL69198
Phase Preclinical
Structure Type MOL
InChI Key JQFROZYWVOCVDM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

378.5
MW (Da)
3.52
ALogP
5
HBA
0
HBD
43.7
PSA (Ų)
0.64
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H26N2O3
MW 378.47
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.69

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00560-G Cannabinoid receptor 1
- 10.1016/0960-894X(95)00560-G Mus musculus 1

Data from ChEMBL 36 via Core Engine