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

CHEMBL359127

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
Nc1ccn(/C=C2\CC2(CO)CO)c(=O)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL359127
Phase Preclinical
Structure Type MOL
InChI Key KNRZCGSGZCQNMA-QPJJXVBHSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names

Molecular Properties

223.2
MW (Da)
-0.96
ALogP
6
HBA
3
HBD
101.4
PSA (Ų)
0.61
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 C10H13N3O3
MW 223.23
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness 0.52

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
14736238 10.1021/jm030316s Human betaherpesvirus 5 3
14736238 10.1021/jm030316s Human gammaherpesvirus 4 3
14736238 10.1021/jm030316s MEF 2
14736238 10.1021/jm030316s HFF 1
14736238 10.1021/jm030316s Human alphaherpesvirus 3 1
14736238 10.1021/jm030316s Hepatitis B virus 1
14736238 10.1021/jm030316s HepG2 1

Data from ChEMBL 36 via Core Engine