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

CHEMBL2152500

EMPETRIFRANZINAN C
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
CCC(C)C(=O)c1c(O)cc2c3c1OC(C)(C)C1CCC(C)(CC31)O2

Basic Information

ChEMBL ID CHEMBL2152500
Name EMPETRIFRANZINAN C
Phase Preclinical
Structure Type MOL
InChI Key FUOLYAMVOGPERE-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names

Molecular Properties

344.4
MW (Da)
4.83
ALogP
4
HBA
1
HBD
55.8
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C21H28O4
MW 344.45
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness 2.66

Activity Summary

IC50 1 meas. best 5.04

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
NON-PROTEIN TARGET
CHEMBL3879801
IC50 5.04 5.04 9200.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
NON-PROTEIN TARGET IC50 = 9200.0 nM 5.04 Antiangiogenic activity in SV-40T transfected human HMEC1 cells assessed as inhi... 23030826

Literature References

PubMed DOI Target Context # Activities
26358281 10.1016/j.bmc.2015.08.028 PC-3 2
26358281 10.1016/j.bmc.2015.08.028 HT-29 2
23030826 10.1021/np300237n NON-PROTEIN TARGET 1
26358281 10.1016/j.bmc.2015.08.028 Human immunodeficiency virus 1 1
26358281 10.1016/j.bmc.2015.08.028 MT4 1
26358281 10.1016/j.bmc.2015.08.028 Escherichia coli 1
26358281 10.1016/j.bmc.2015.08.028 Staphylococcus aureus 1
26358281 10.1016/j.bmc.2015.08.028 Enterococcus faecalis 1

Data from ChEMBL 36 via Core Engine