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

CHEMBL4745706

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
COc1cccc(OC)c1NC(=O)NS(=O)(=O)/C=C/c1nccs1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4745706
Phase Preclinical
Structure Type MOL
InChI Key WSJMPFSWSGYREF-RMKNXTFCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

369.4
MW (Da)
2.28
ALogP
7
HBA
2
HBD
106.6
PSA (Ų)
0.81
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H15N3O5S2
MW 369.42
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -1.36

Literature References

PubMed DOI Target Context # Activities
32980515 10.1016/j.bmcl.2020.127571 NACHT, LRR and PYD domains-containing protein 3 2

Data from ChEMBL 36 via Core Engine