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Compound Detail

CHEMBL209341

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CC(C)C[C@H](NC(=O)CN)C(=O)NCC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL209341
Phase Preclinical
Structure Type BOTH
InChI Key CCBIBMKQNXHNIN-ZETCQYMHSA-N
0
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

245.3
MW (Da)
-1.32
ALogP
4
HBA
4
HBD
121.5
PSA (Ų)
0.44
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H19N3O4
MW 245.28
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness -0.07

Activity Summary

EC50 1 meas.
IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
16759105 10.1021/jm0511029 Solute carrier family 15 member 1 4

Data from ChEMBL 36 via Core Engine