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Compound Detail

CHEMBL75782

DIHYDROOROTATE
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O=C1CC(C(=O)O)NC(=O)N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL75782
Name DIHYDROOROTATE
Phase Preclinical
Structure Type MOL
InChI Key UFIVEPVSAGBUSI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

158.1
MW (Da)
-1.33
ALogP
3
HBA
3
HBD
95.5
PSA (Ų)
0.44
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C5H6N2O4
MW 158.11
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 0.50

Literature References

PubMed DOI Target Context # Activities
17228860 10.1021/jm060687j Dihydroorotate dehydrogenase (quinone), mitochondrial 3
6141293 10.1021/jm00368a022 Multifunctional protein CAD 1
17228860 10.1021/jm060687j Dihydroorotate dehydrogenase 1

Data from ChEMBL 36 via Core Engine