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Compound Detail

CHEMBL1222147

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N[C@@H](C[C@@H](CCCC(=O)NCC(=O)Nc1ccccc1)C(=O)O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1222147
Phase Preclinical
Structure Type MOL
InChI Key XKVOHIXGSHTPCI-YPMHNXCESA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

365.4
MW (Da)
0.41
ALogP
5
HBA
5
HBD
158.8
PSA (Ų)
0.38
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H23N3O6
MW 365.39
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -0.36

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
16408092 10.1038/nchembio756 Glutamate receptor ionotropic, kainate 2 2

Data from ChEMBL 36 via Core Engine