Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL85062

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCCC(=O)Nc1nc(O)c2[nH]cnc2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL85062
Phase Preclinical
Structure Type MOL
InChI Key NLQPNFQTSJQJAH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

221.2
MW (Da)
0.80
ALogP
5
HBA
3
HBD
103.8
PSA (Ų)
0.71
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 C9H11N5O2
MW 221.22
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -1.16

Literature References

PubMed DOI Target Context # Activities
8691450 10.1021/jm950876u Xanthine dehydrogenase/oxidase 1

Data from ChEMBL 36 via Core Engine