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Compound Detail

CHEMBL312826

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O=C1Nc2ccccc2/C1=C\c1ccco1

Basic Information

ChEMBL ID CHEMBL312826
Phase Preclinical
Structure Type MOL
InChI Key PGZGBDVILWVGSF-DHZHZOJOSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

211.2
MW (Da)
2.77
ALogP
2
HBA
1
HBD
42.2
PSA (Ų)
0.74
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H9NO2
MW 211.22
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.71

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
10956210 10.1021/jm990609e Vascular endothelial growth factor receptor 2 1
9651163 10.1021/jm980123i Platelet-derived growth factor receptor beta 1
9651163 10.1021/jm980123i Vascular endothelial growth factor receptor 1 1
9651163 10.1021/jm980123i Epidermal growth factor receptor 1
9651163 10.1021/jm980123i Receptor tyrosine-protein kinase erbB-2 1
9651163 10.1021/jm980123i Insulin-like growth factor 1 receptor 1

Data from ChEMBL 36 via Core Engine