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Compound Detail

CHEMBL243596

IMINOSTILBENE
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C1=Cc2ccccc2Nc2ccccc21

Basic Information

ChEMBL ID CHEMBL243596
Name IMINOSTILBENE
Phase Preclinical
Structure Type MOL
InChI Key LCGTWRLJTMHIQZ-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names

Molecular Properties

193.2
MW (Da)
3.91
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.57
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C14H11N
MW 193.25
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness 0.23

Activity Summary

IC50 2 meas. best 5.59

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
U-937
CHEMBL612794
IC50 5.59 5.59 2580.0 1
Unchecked
CHEMBL612545
IC50 5.32 5.32 4790.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
17236778 10.1016/j.bmc.2007.01.007 Erythrocyte 10
24900465 10.1021/ml200266v U-937 1
- 10.1039/C3MD00397C HepG2 1
- 10.6019/CHEMBL4296182 Escherichia coli 1
- 10.6019/CHEMBL4296182 Klebsiella pneumoniae 1
- 10.6019/CHEMBL4296182 Candida albicans 1
- 10.6019/CHEMBL4296182 Cryptococcus neoformans 1
- 10.6019/CHEMBL4296182 Staphylococcus aureus 1
- 10.6019/CHEMBL4296182 Acinetobacter baumannii 1
- 10.6019/CHEMBL4296182 Pseudomonas aeruginosa 1

Data from ChEMBL 36 via Core Engine