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Compound Detail

CHEMBL5767028

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O=C(Cn1cc(Cl)c2ncc(-c3cc(F)cc(F)c3)cc21)N1CC(F)C1

Basic Information

ChEMBL ID CHEMBL5767028
Phase Preclinical
Structure Type MOL
InChI Key PNGDVXXQNKMIQE-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

379.8
MW (Da)
3.82
ALogP
3
HBA
0
HBD
38.1
PSA (Ų)
0.69
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H13ClF3N3O
MW 379.77
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.42

Activity Summary

IC50 1 meas. best 7.9

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, NMDA 2B
CHEMBL1904
IC50 7.9 7.9 12.6 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine