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Compound Detail

CHEMBL263379

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CCOc1ncnc2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL263379
Phase Preclinical
Structure Type MOL
InChI Key KHYIWRGNPLBXDS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

174.2
MW (Da)
2.03
ALogP
3
HBA
0
HBD
35.0
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C10H10N2O
MW 174.20
Aromatic Rings 2
Heavy Atoms 13
NP-Likeness -1.49

Literature References

PubMed DOI Target Context # Activities
18341273 10.1021/jm701509k Hematopoietic prostaglandin D synthase 1

Data from ChEMBL 36 via Core Engine