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

CHEMBL1934478

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
Cc1sc(-c2ccc(Cl)cc2)nc1C(=O)N[C@H]1CCCN(c2cccc(C(=O)O)c2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1934478
Phase Preclinical
Structure Type MOL
InChI Key VXKRGWIWCCWRLT-SFHVURJKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

456.0
MW (Da)
4.87
ALogP
5
HBA
2
HBD
82.5
PSA (Ų)
0.57
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H22ClN3O3S
MW 455.97
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.75

Literature References

PubMed DOI Target Context # Activities
22133631 10.1016/j.bmcl.2011.11.002 Peroxisome proliferator-activated receptor alpha 1
22133631 10.1016/j.bmcl.2011.11.002 Peroxisome proliferator-activated receptor gamma 1
22133631 10.1016/j.bmcl.2011.11.002 Peroxisome proliferator-activated receptor delta 1

Data from ChEMBL 36 via Core Engine