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Compound Detail

CHEMBL12896

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

Basic Information

ChEMBL ID CHEMBL12896
Phase Preclinical
Structure Type MOL
InChI Key GMONASUDUSDTLN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

353.3
MW (Da)
2.64
ALogP
7
HBA
2
HBD
97.5
PSA (Ų)
0.69
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 C15H10F3N3O4
MW 353.26
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.92

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