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

CHEMBL273867

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
CCCN(CCC)C1Cc2cccc3c2N(C1)C(=O)NC3

Basic Information

ChEMBL ID CHEMBL273867
Phase Preclinical
Structure Type MOL
InChI Key GZQMSNKBMQEZJK-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

287.4
MW (Da)
2.76
ALogP
2
HBA
1
HBD
35.6
PSA (Ų)
0.90
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H25N3O
MW 287.41
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.93

Activity Summary

Ki 1 meas. best 8.49

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
5-hydroxytryptamine receptor 1A
CHEMBL214
Ki 8.49 8.49 3.2 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
1348089 10.1021/jm00084a013 5-hydroxytryptamine receptor 1A 2
1348089 10.1021/jm00084a013 Rattus norvegicus 2
1348089 10.1021/jm00084a013 D(2) dopamine receptor 1
1348089 10.1021/jm00084a013 NON-PROTEIN TARGET 1

Data from ChEMBL 36 via Core Engine