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Compound Detail

CHEMBL114793

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N#C/C(=C\c1ccc(F)cc1)C(=O)NCCCCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL114793
Phase Preclinical
Structure Type MOL
InChI Key YOEXFIPEEPDNEU-NBVRZTHBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

322.4
MW (Da)
3.87
ALogP
2
HBA
1
HBD
52.9
PSA (Ų)
0.48
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19FN2O
MW 322.38
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -1.01

Literature References

PubMed DOI Target Context # Activities
10464027 10.1021/jm990199u Glutamate NMDA receptor; Grin1/Grin2a 1
10464027 10.1021/jm990199u Glutamate NMDA receptor; Grin1/Grin2b 1
10464027 10.1021/jm990199u Glutamate NMDA receptor; Grin1/Grin2c 1

Data from ChEMBL 36 via Core Engine