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Compound Detail

CHEMBL494878

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CCCNC(=O)CC[C@H](C[C@H](N)C(=O)O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL494878
Phase Preclinical
Structure Type MOL
InChI Key WCFYSXVBDAPIFZ-SFYZADRCSA-N
0
Targets
6
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

260.3
MW (Da)
-0.20
ALogP
4
HBA
4
HBD
129.7
PSA (Ų)
0.45
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H20N2O5
MW 260.29
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 0.20

Activity Summary

IC50 4 meas.
Ki 2 meas.

Literature References

PubMed DOI Target Context # Activities
18578477 10.1021/jm800091e Excitatory amino acid transporter 1 4
18578477 10.1021/jm800091e Excitatory amino acid transporter 2 4
18578477 10.1021/jm800091e Excitatory amino acid transporter 3 4

Data from ChEMBL 36 via Core Engine