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

CHEMBL3143223

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
O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1-c1cscc1Br
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3143223
Phase Preclinical
Structure Type MOL
InChI Key BKJOSZFLRXVYPW-HBNTYKKESA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

389.2
MW (Da)
0.67
ALogP
7
HBA
3
HBD
104.5
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 C13H13BrN2O5S
MW 389.23
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness 0.53

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
8941385 10.1021/jm960278v Thymidine kinase 1

Data from ChEMBL 36 via Core Engine