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Compound Detail

CHEMBL404693

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CN1C(=O)C(=Cc2ccc(C(=O)O)cc2)C(=O)N(C)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL404693
Phase Preclinical
Structure Type MOL
InChI Key AQSYFFQBGWKBLD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

288.3
MW (Da)
0.82
ALogP
4
HBA
1
HBD
95.0
PSA (Ų)
0.64
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H12N2O5
MW 288.26
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.65

Literature References

PubMed DOI Target Context # Activities
18343108 10.1016/j.bmcl.2008.02.066 Unchecked 1
18343108 10.1016/j.bmcl.2008.02.066 Methionine aminopeptidase 1 1

Data from ChEMBL 36 via Core Engine