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Compound Detail

CHEMBL361880

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

Basic Information

ChEMBL ID CHEMBL361880
Phase Preclinical
Structure Type BOTH
InChI Key BYXHQQCXAJARLQ-JKUQZMGJSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

231.2
MW (Da)
-1.57
ALogP
4
HBA
4
HBD
121.5
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C9H17N3O4
MW 231.25
Aromatic Rings 0
Heavy Atoms 16
NP-Likeness -0.17

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
15974593 10.1021/jm048982w Solute carrier family 15 member 1 1

Data from ChEMBL 36 via Core Engine