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

CHEMBL505208

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
Cc1[nH]c(C)c(-c2ccccc2)c(=O)c1Cl

Basic Information

ChEMBL ID CHEMBL505208
Phase Preclinical
Structure Type MOL
InChI Key ABLJWJFERMBXOT-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

233.7
MW (Da)
3.31
ALogP
1
HBA
1
HBD
32.9
PSA (Ų)
0.81
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H12ClNO
MW 233.70
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.51

Activity Summary

IC50 1 meas. best 4.96

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Plasmodium falciparum
CHEMBL364
IC50 4.96 4.96 11000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Plasmodium falciparum IC50 = 11000.0 nM 4.96 Antimalarial activity against Plasmodium falciparum T9-96 infected Rhesus positi... 18396855

Literature References

PubMed DOI Target Context # Activities
18396855 10.1021/jm0705760 Plasmodium falciparum 1
18396855 10.1021/jm0705760 Plasmodium yoelii 1

Data from ChEMBL 36 via Core Engine