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Compound Detail

CHEMBL5757249

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CCC(=O)Cn1cc(F)c2ncc(-c3ccc(F)c(F)c3)cc21

Basic Information

ChEMBL ID CHEMBL5757249
Phase Preclinical
Structure Type MOL
InChI Key SRSYTIHMXUQAII-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

318.3
MW (Da)
4.10
ALogP
3
HBA
0
HBD
34.9
PSA (Ų)
0.73
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H13F3N2O
MW 318.30
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.20

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