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Compound Detail

CHEMBL13176

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O=C(O)c1cccn1-c1cc2nc(O)c(O)nc2cc1C(F)(F)F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL13176
Phase Preclinical
Structure Type MOL
InChI Key YGFYXARNVHSRQY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

339.2
MW (Da)
2.55
ALogP
6
HBA
3
HBD
108.5
PSA (Ų)
0.66
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H8F3N3O4
MW 339.23
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.91

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(97)00170-4 Glutamate receptor ionotropic AMPA 1

Data from ChEMBL 36 via Core Engine