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Compound Detail

CHEMBL440660

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Cc1c(-c2ccc(-c3ccccc3F)cc2)[nH]c2ncnc-2c1C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL440660
Phase Preclinical
Structure Type MOL
InChI Key OFCYZVMXXDRSCK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

347.4
MW (Da)
4.39
ALogP
3
HBA
2
HBD
78.9
PSA (Ų)
0.58
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H14FN3O2
MW 347.35
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.63

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00252-O Dihydroorotate dehydrogenase (quinone), mitochondrial 1
- 10.1016/0960-894X(95)00252-O ADMET 1

Data from ChEMBL 36 via Core Engine