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

CHEMBL3815157

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
Cc1cc(NCCC(C)C)cc(=O)n1Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3815157
Phase Preclinical
Structure Type MOL
InChI Key IQBWQUVEORWKAE-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

284.4
MW (Da)
3.66
ALogP
3
HBA
1
HBD
34.0
PSA (Ų)
0.88
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H24N2O
MW 284.40
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.13

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
27265687 10.1016/j.bmc.2016.05.043 Alpha-2A adrenergic receptor 3
27265687 10.1016/j.bmc.2016.05.043 K562 1
38160616 10.1016/j.ejmech.2023.116063 HepG2 1

Data from ChEMBL 36 via Core Engine