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Compound Detail

CHEMBL224337

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O=C(Nc1ccc(I)cc1)NC(c1ccccc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL224337
Phase Preclinical
Structure Type MOL
InChI Key ZVDOZRLSSIYSTM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

428.3
MW (Da)
5.20
ALogP
1
HBA
2
HBD
41.1
PSA (Ų)
0.55
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H17IN2O
MW 428.27
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.55

Literature References

PubMed DOI Target Context # Activities
16279809 10.1021/jm0503906 Cannabinoid receptor 1 2
16279809 10.1021/jm0503906 Cannabinoid receptor 2 1

Data from ChEMBL 36 via Core Engine