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

CHEMBL2036520

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
COC(=O)c1ncn(CC=C2OC(=O)C(O)=C2O)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2036520
Phase Preclinical
Structure Type MOL
InChI Key UVWYRROKKOMQEE-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names

Molecular Properties

267.2
MW (Da)
-0.17
ALogP
9
HBA
2
HBD
123.8
PSA (Ų)
0.72
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 C10H9N3O6
MW 267.20
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.35

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
22555152 10.1016/j.bmc.2012.01.054 Hepatitis C virus 2
22555152 10.1016/j.bmc.2012.01.054 CCRF-CEM 1
22555152 10.1016/j.bmc.2012.01.054 Unchecked 1
22555152 10.1016/j.bmc.2012.01.054 ADMET 1
22555152 10.1016/j.bmc.2012.01.054 WI-38 1
22555152 10.1016/j.bmc.2012.01.054 MIA PaCa-2 1
22555152 10.1016/j.bmc.2012.01.054 SW-620 1
22555152 10.1016/j.bmc.2012.01.054 HepG2 1
22555152 10.1016/j.bmc.2012.01.054 MCF7 1
22555152 10.1016/j.bmc.2012.01.054 HeLa 1

Data from ChEMBL 36 via Core Engine