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

CHEMBL320369

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
Nc1nc(N)c2c(N)c(N)ccc2n1

Basic Information

ChEMBL ID CHEMBL320369
Phase Preclinical
Structure Type MOL
InChI Key QTMJIODDNNBRTK-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

190.2
MW (Da)
-0.04
ALogP
6
HBA
4
HBD
129.9
PSA (Ų)
0.43
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H10N6
MW 190.21
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -0.65

Activity Summary

IC50 2 meas. best 5.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.0 5.0 10000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 10000.0 nM 5.0 Ability to inhibit formation of the TatTAR complex by binding to the closing GC ... 12270158

Literature References

PubMed DOI Target Context # Activities
12270158 10.1016/s0960-894x(02)00636-4 Unchecked 1
12270158 10.1016/s0960-894x(02)00636-4 Nucleic Acid 1

Data from ChEMBL 36 via Core Engine