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

CHEMBL24078

ELLIPTINIUM ACETATE
🧪 Phase II
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
🧪 Phase II
CC(=O)[O-].Cc1c2cc[n+](C)cc2c(C)c2c1[nH]c1ccc(O)cc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL24078
Name ELLIPTINIUM ACETATE
Phase Phase II
Structure Type MOL
InChI Key BOMZMNZEXMAQQW-UHFFFAOYSA-N
Parent Compound CHEMBL16699
Active Moiety CHEMBL16699

Known Names

Acetate d'elliptinium Acetato de eliptinio Celiptium Elliptinium acetate NSC-264137
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
10
Publications
5
Known Names

Molecular Properties

277.4
MW (Da)
3.62
ALogP
1
HBA
2
HBD
39.9
PSA (Ų)
0.47
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral
USAN Stem -ium

Extended Properties

Molecular Formula C20H20N2O3
MW 336.39
Aromatic Rings 4
Heavy Atoms 21
NP-Likeness 1.09

Activity Summary

IC50 2 meas. best 7.42

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
MC-38
CHEMBL612821
 IC50 7.42 7.42 38.0 1
L1210
CHEMBL386
 IC50 7.14 7.14 73.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
MC-38 IC50 = 38.0 nM 7.42 Tested for cytotoxicity against C38 cell lines measured by MAT assay 8057291
L1210 IC50 = 73.0 nM 7.14 In vitro cytotoxicity against L1210 (murine leukemia) cells. 8057291

Literature References

PubMed DOI Target Context # Activities
8027977 10.1021/jm00039a007 Tumor Cell line 6
3385725 10.1021/jm00402a007 Mus musculus 6
8035425 10.1021/jm00040a010 Homo sapiens 3
8057291 10.1021/jm00041a024 Mus musculus 2
3746819 10.1021/jm00159a028 L1210 2
8057291 10.1021/jm00041a024 L1210 1
8057291 10.1021/jm00041a024 MC-38 1
3090263 10.1021/jm00158a005 L1210 1
3746819 10.1021/jm00159a028 Calf thymus DNA 1
8035425 10.1021/jm00040a010 Unchecked 1

Data from ChEMBL 36 via Core Engine