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Compound Detail

CHEMBL402380

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CC1(c2ccccc2)C(=O)Nc2cc(Cl)ccc2C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL402380
Phase Preclinical
Structure Type MOL
InChI Key NEAMUCFKQGSSLC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

285.7
MW (Da)
3.43
ALogP
2
HBA
1
HBD
46.2
PSA (Ų)
0.82
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H12ClNO2
MW 285.73
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness 0.12

Literature References

PubMed DOI Target Context # Activities
18053713 10.1016/j.bmcl.2007.11.045 5-hydroxytryptamine receptor 6 1

Data from ChEMBL 36 via Core Engine