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Compound Detail

CHEMBL4293063

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NCCCCCCCCNC(=O)COc1ccc2c(c1)c(C(=O)c1cccc3ccccc13)cn2CCN1CCOCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4293063
Phase Preclinical
Structure Type MOL
InChI Key WLNBBLLIHSJPAH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

584.8
MW (Da)
5.15
ALogP
7
HBA
2
HBD
98.8
PSA (Ų)
0.14
QED
2
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H44N4O4
MW 584.76
Aromatic Rings 4
Heavy Atoms 43
NP-Likeness -1.11

Literature References

PubMed DOI Target Context # Activities
29407590 10.1016/j.ejmech.2017.11.076 Cannabinoid receptor 2 2
29407590 10.1016/j.ejmech.2017.11.076 Cannabinoid receptor 1 2

Data from ChEMBL 36 via Core Engine