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Compound Detail

CHEMBL273276

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COC(=O)C(Cc1c[nH]c2ccccc12)N(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL273276
Phase Preclinical
Structure Type MOL
InChI Key QFHMLRWKLHONAO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

246.3
MW (Da)
1.81
ALogP
3
HBA
1
HBD
45.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C14H18N2O2
MW 246.31
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness 0.02

Literature References

PubMed DOI Target Context # Activities
6127411 10.1021/jm00351a015 GABA-A receptor; anion channel 1

Data from ChEMBL 36 via Core Engine