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Compound Detail

CHEMBL443286

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CNC12CC3CC(CC(C3)C1)C2

Basic Information

ChEMBL ID CHEMBL443286
Phase Preclinical
Structure Type MOL
InChI Key NZOLSRPWNVZXTK-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

165.3
MW (Da)
2.17
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.63
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 C11H19N
MW 165.28
Aromatic Rings 0
Heavy Atoms 12
NP-Likeness -0.15

Activity Summary

Ki 1 meas. best 4.66

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate [NMDA] receptor
CHEMBL2094124
Ki 4.66 4.66 21700.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
9464369 10.1021/jm9704412 Glutamate [NMDA] receptor 1

Data from ChEMBL 36 via Core Engine