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Compound Detail

CHEMBL1329032

ISOSPAGLUMIC ACID
🧪 Phase II
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🧪 Phase II
CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1329032
Name ISOSPAGLUMIC ACID
Phase Phase II
Structure Type MOL
InChI Key OPVPGKGADVGKTG-BQBZGAKWSA-N

Known Names

Acide isospaglumique Acido isospaglumico Isospaglumic acid N-acetylaspartylglutamate N-acetylaspartylglutamic acid Naaga ZY 15106 ZY-15106
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
10
Publications
8
Known Names

Molecular Properties

304.2
MW (Da)
-1.60
ALogP
5
HBA
5
HBD
170.1
PSA (Ų)
0.34
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Flags

Natural Product

Extended Properties

Molecular Formula C11H16N2O8
MW 304.25
Aromatic Rings 0
Heavy Atoms 21
NP-Likeness 0.51

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
21923190 10.1021/jm200807m Glutamate carboxypeptidase 2 9
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
17567119 10.1021/jm070133w Glutamate carboxypeptidase 2 1
21923190 10.1021/jm200807m Unchecked 1
9755050 10.1152/ajpcell.1998.275.4.c967 Solute carrier family 15 member 2 1
- 10.1101/2020.04.03.023846 SARS-CoV-2 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1

Data from ChEMBL 36 via Core Engine