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Compound Detail

CHEMBL23396

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O=C(O)c1[nH]c2cc(Cl)ccc2c1CCCl

Basic Information

ChEMBL ID CHEMBL23396
Phase Preclinical
Structure Type MOL
InChI Key RLVSMVRRAOLHOK-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

258.1
MW (Da)
3.30
ALogP
1
HBA
2
HBD
53.1
PSA (Ų)
0.83
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H9Cl2NO2
MW 258.10
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.41

Activity Summary

Ki 1 meas. best 4.88

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate NMDA receptor
CHEMBL1907608
Ki 4.88 4.88 13200.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
1849994 10.1021/jm00108a007 Glutamate NMDA receptor 1

Data from ChEMBL 36 via Core Engine