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

CHEMBL64379

MALINAMIDE
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
CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC(C)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL64379
Name MALINAMIDE
Phase Preclinical
Structure Type MOL
InChI Key RWIUTHWKQHRQNP-NQLNTKRDSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

383.6
MW (Da)
7.68
ALogP
1
HBA
1
HBD
29.1
PSA (Ų)
0.23
QED
1
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H41NO
MW 383.62
Aromatic Rings 1
Heavy Atoms 28
NP-Likeness 0.17

Activity Summary

IC50 2 meas. best 5.5

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
 IC50 5.5 5.5 3200.0 1
THP-1
CHEMBL614245
 IC50 5.28 5.28 5200.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 3200.0 nM 5.5 Inhibition of small intimal microsomal fraction of rabbit ACAT using [1-14C]oleo... 36473091
THP-1 IC50 = 5200.0 nM 5.28 Inhibition of LPS-induced TNFalpha production in human THP-1 cells incubated for... 33479624

Literature References

PubMed DOI Target Context # Activities
10450977 10.1016/s0960-894x(99)00330-3 Sterol O-acyltransferase 1 2
33479624 10.1039/d0md00208a THP-1 2
36473091 10.1021/acs.jmedchem.2c01265 Unchecked 2

Data from ChEMBL 36 via Core Engine