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

CHEMBL1185605

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
NCCCNCCCCNCCCNCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185605
Phase Preclinical
Structure Type MOL
InChI Key BXEVLOZJWSSRDM-UHFFFAOYSA-N
0
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

292.5
MW (Da)
1.47
ALogP
4
HBA
4
HBD
62.1
PSA (Ų)
0.39
QED
0
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H32N4
MW 292.47
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.30

Activity Summary

Ki 4 meas.

Literature References

PubMed DOI Target Context # Activities
24140951 10.1016/j.ejmech.2013.07.005 Amine oxidase [flavin-containing] B 4
24140951 10.1016/j.ejmech.2013.07.005 Amine oxidase [flavin-containing] A 4
24140951 10.1016/j.ejmech.2013.07.005 Amine oxidase [copper-containing] 3 2
24140951 10.1016/j.ejmech.2013.07.005 Unchecked 1

Data from ChEMBL 36 via Core Engine