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Compound Detail

CHEMBL259123

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CC[C@@H](C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL259123
Phase Preclinical
Structure Type BOTH
InChI Key NXRNRBOKDBIVKQ-ZQEFQCJFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

457.5
MW (Da)
1.31
ALogP
6
HBA
6
HBD
162.0
PSA (Ų)
0.30
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H31N3O6
MW 457.53
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness 0.31

Literature References

PubMed DOI Target Context # Activities
18096385 10.1016/j.bmcl.2007.11.130 Unchecked 1

Data from ChEMBL 36 via Core Engine