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

CHEMBL180783

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
CCc1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL180783
Phase Preclinical
Structure Type MOL
InChI Key ABRITLIVAGXION-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

328.4
MW (Da)
3.25
ALogP
2
HBA
2
HBD
62.0
PSA (Ų)
0.73
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H20N2O2S
MW 328.44
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.16

Literature References

PubMed DOI Target Context # Activities
15713402 10.1016/j.bmcl.2004.12.081 Polyunsaturated fatty acid lipoxygenase ALOX15 2

Data from ChEMBL 36 via Core Engine