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Compound Detail

CHEMBL1641941

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CC(NC(=O)c1cn(-c2ccccc2)c(-c2ccccc2)cc1=O)C12CC3CC(CC(C3)C1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1641941
Phase Preclinical
Structure Type MOL
InChI Key STBBFKKMBXBNPB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

452.6
MW (Da)
5.84
ALogP
3
HBA
1
HBD
51.1
PSA (Ų)
0.53
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H32N2O2
MW 452.60
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.50

Literature References

PubMed DOI Target Context # Activities
20979417 10.1021/jm100286k Cannabinoid receptor 1 1
20979417 10.1021/jm100286k Cannabinoid receptor 2 1

Data from ChEMBL 36 via Core Engine