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Compound Detail

CHEMBL2105028

DODICIN
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CCCCCCCCCCCCNCCNCCNCC(=O)O

Basic Information

ChEMBL ID CHEMBL2105028
Name DODICIN
Phase Preclinical
Structure Type MOL
InChI Key FSKNXCHJIFBRBT-UHFFFAOYSA-N

Known Names

Dodicin Lauryl diethylenediaminoglycine
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
2
Known Names

Molecular Properties

329.5
MW (Da)
2.76
ALogP
4
HBA
4
HBD
73.4
PSA (Ų)
0.27
QED
0
Ro5 Violations
19
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Extended Properties

Molecular Formula C18H39N3O2
MW 329.53
Aromatic Rings 0
Heavy Atoms 23
NP-Likeness 0.05

Activity Summary

IC50 1 meas. best 5.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.22 5.22 6040.4 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 6040.4 nM 5.22 PubChem BioAssay. VEGF stimulated ADSC/ECFC co-culture CD31-stained tube area de... -

Data from ChEMBL 36 via Core Engine