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Compound Detail

CHEMBL5920572

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CN(C)C(=O)Cn1c(=O)n(C)c2ncc(-c3ccc(Cl)s3)cc21

Basic Information

ChEMBL ID CHEMBL5920572
Phase Preclinical
Structure Type MOL
InChI Key UZJDNVUOCFAGJJ-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

350.8
MW (Da)
2.21
ALogP
6
HBA
0
HBD
60.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H15ClN4O2S
MW 350.83
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -2.01

Activity Summary

IC50 2 meas. best 8.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, NMDA 2B
CHEMBL1904
IC50 8.3 8.3 5.0 1
Glutamate NMDA receptor; GRIN1/GRIN2B
CHEMBL1907603
IC50 8.3 8.3 5.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine