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

CHEMBL126215

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
CN1CC2c3c(N)cccc3C1C1C=CCC21

Basic Information

ChEMBL ID CHEMBL126215
Phase Preclinical
Structure Type MOL
InChI Key KQEBFIGSBWGPFB-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

226.3
MW (Da)
2.54
ALogP
2
HBA
1
HBD
29.3
PSA (Ų)
0.54
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H18N2
MW 226.32
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.87

Activity Summary

Ki 1 meas. best 6.15

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
Ki 6.15 6.15 701.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked Ki = 701.0 nM 6.15 Binding affinity against PCP site of the NMDA Receptor using [3H]TCP radioligand -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00038-U Unchecked 1

Data from ChEMBL 36 via Core Engine