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Compound Detail

CHEMBL350120

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CN1C(=O)CN=C(c2ccccc2F)c2c1ccc1ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL350120
Phase Preclinical
Structure Type MOL
InChI Key ZCMOJCCQKZQWMU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

318.4
MW (Da)
3.79
ALogP
2
HBA
0
HBD
32.7
PSA (Ų)
0.67
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 C20H15FN2O
MW 318.35
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.42

Literature References

PubMed DOI Target Context # Activities
8145224 10.1021/jm00032a007 GABA-A receptor; anion channel 1

Data from ChEMBL 36 via Core Engine