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Compound Detail

CHEMBL3298928

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C=CC(=O)N(Cc1ccccc1)NC(=O)OC(C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3298928
Phase Preclinical
Structure Type MOL
InChI Key FPYRLQBPXRLUTF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

276.3
MW (Da)
2.64
ALogP
3
HBA
1
HBD
58.6
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H20N2O3
MW 276.34
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.37

Literature References

PubMed DOI Target Context # Activities
24900862 10.1021/ml500088x RAC-alpha serine/threonine-protein kinase 1

Data from ChEMBL 36 via Core Engine