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

CHEMBL243186

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=Cc1cc(O)ccc1O

Basic Information

ChEMBL ID CHEMBL243186
Phase Preclinical
Structure Type MOL
InChI Key CLFRCXCBWIQVRN-UHFFFAOYSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

138.1
MW (Da)
0.91
ALogP
3
HBA
2
HBD
57.5
PSA (Ų)
0.45
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C7H6O3
MW 138.12
Aromatic Rings 1
Heavy Atoms 10
NP-Likeness 1.24

Activity Summary

IC50 3 meas. best 5.48

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Leishmania donovani
CHEMBL367
IC50 5.48 5.48 3300.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Leishmania donovani IC50 = 3300.0 nM 5.48 Antileishmanial activity against promastigote forms of Leishmania donovani by al... 25084548

Literature References

PubMed DOI Target Context # Activities
26986086 10.1016/j.ejmech.2016.03.008 Unchecked 11
17258462 10.1016/j.bmc.2006.12.038 Unchecked 2
25084548 10.1021/np5000473 Leishmania donovani 2
2614420 10.1021/np50066a009 Epidermal growth factor receptor 1
26986086 10.1016/j.ejmech.2016.03.008 No relevant target 1
28197313 10.1021/acsmedchemlett.6b00417 Myeloperoxidase 1

Data from ChEMBL 36 via Core Engine