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Compound Detail

CHEMBL1923767

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CCCCCc1cc(O)cc(OCCCCCCCCCCOC(CO)CO)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1923767
Phase Preclinical
Structure Type MOL
InChI Key ZCNPXLYYLKFHFM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

410.6
MW (Da)
4.99
ALogP
5
HBA
3
HBD
79.2
PSA (Ų)
0.28
QED
0
Ro5 Violations
19
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H42O5
MW 410.60
Aromatic Rings 1
Heavy Atoms 29
NP-Likeness 0.62

Literature References

PubMed DOI Target Context # Activities
22044209 10.1021/jm200529h Cannabinoid receptor 1 1
22044209 10.1021/jm200529h Cannabinoid receptor 2 1

Data from ChEMBL 36 via Core Engine