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Compound Detail

CHEMBL5932849

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Cc1csc(-c2cnc3c(F)cn(CC(=O)N4CCC4)c3c2)c1

Basic Information

ChEMBL ID CHEMBL5932849
Phase Preclinical
Structure Type MOL
InChI Key KKQSFMXBXCOGOC-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

329.4
MW (Da)
3.44
ALogP
4
HBA
0
HBD
38.1
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H16FN3OS
MW 329.40
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.78

Activity Summary

IC50 1 meas. best 7.7

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, NMDA 2B
CHEMBL1904
IC50 7.7 7.7 20.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine