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

CHEMBL5175761

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
OC[C@H]1O[C@@H](c2n[nH]c3c(S)ncnc23)[C@H](O)[C@@H]1O

Basic Information

ChEMBL ID CHEMBL5175761
Phase Preclinical
Structure Type MOL
InChI Key LQKUBPCOEHEOEC-KSYZLYKTSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

284.3
MW (Da)
-1.20
ALogP
8
HBA
5
HBD
124.4
PSA (Ų)
0.35
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H12N4O4S
MW 284.30
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness 0.57

Activity Summary

IC50 1 meas. best 6.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Influenza A virus
CHEMBL613740
IC50 6.24 6.24 571.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Influenza A virus IC50 = 571.0 nM 6.24 Antiviral activity against Influenza A virus A/WSN/33(H1N1) infected in dog MDCK... 35092894

Literature References

PubMed DOI Target Context # Activities
35092894 10.1016/j.bmc.2022.116613 Influenza A virus 1
35092894 10.1016/j.bmc.2022.116613 MDCK 1

Data from ChEMBL 36 via Core Engine