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Compound Detail

CHEMBL234883

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COc1ccc(-c2cccc(CCN(C)C)c2)cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL234883
Phase Preclinical
Structure Type MOL
InChI Key OVSKAXCAXWEFAU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

285.4
MW (Da)
3.47
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.81
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H23NO2
MW 285.39
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.25

Literature References

PubMed DOI Target Context # Activities
17419056 10.1016/j.bmcl.2007.03.054 5-hydroxytryptamine receptor 7 3
17419056 10.1016/j.bmcl.2007.03.054 5-hydroxytryptamine receptor 1A 3

Data from ChEMBL 36 via Core Engine