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Compound Detail

CHEMBL455557

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Cc1cc2cc(I)ccc2oc1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL455557
Phase Preclinical
Structure Type MOL
InChI Key BFLNDZDGFIJKQP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

286.1
MW (Da)
2.71
ALogP
2
HBA
0
HBD
30.2
PSA (Ų)
0.55
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H7IO2
MW 286.07
Aromatic Rings 2
Heavy Atoms 13
NP-Likeness -0.35

Literature References

PubMed DOI Target Context # Activities
23679955 10.1021/jm4005175 G-protein coupled receptor 55 3
19278853 10.1016/j.bmc.2009.02.027 Cannabinoid receptor 2 2
19278853 10.1016/j.bmc.2009.02.027 Cannabinoid receptor 1 2

Data from ChEMBL 36 via Core Engine