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

CHEMBL151150

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
CN[C@]12CCCC[C@H]1CCc1ccccc12

Basic Information

ChEMBL ID CHEMBL151150
Phase Preclinical
Structure Type MOL
InChI Key PKFYGNRBXOMAQD-DZGCQCFKSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

215.3
MW (Da)
3.24
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.76
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H21N
MW 215.34
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness 0.92

Activity Summary

IC50 1 meas. best 7.83

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate NMDA receptor
CHEMBL1907608
IC50 7.83 7.83 14.7 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Glutamate NMDA receptor IC50 = 14.7 nM 7.83 Inhibitory concentration of compound required to displace [3H]TCP 1-[ 1-(2-thien... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80090-6 Mus musculus 2
- 10.1016/S0960-894X(00)80090-6 Glutamate NMDA receptor 1
- 10.1016/S0960-894X(00)80090-6 No relevant target 1

Data from ChEMBL 36 via Core Engine