Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL599251

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCOC(=O)[C@@H]1O[C@H]1C(=O)Nc1ccc2ccccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL599251
Phase Preclinical
Structure Type MOL
InChI Key BZZSURQBWUIAHM-ZIAGYGMSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

285.3
MW (Da)
2.11
ALogP
4
HBA
1
HBD
67.9
PSA (Ų)
0.69
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H15NO4
MW 285.30
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.60

Literature References

PubMed DOI Target Context # Activities
20151670 10.1021/jm901558p Epidermal growth factor receptor 5
20151670 10.1021/jm901558p A-431 1

Data from ChEMBL 36 via Core Engine