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Compound Detail

CHEMBL205138

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CC(C)(C)c1ccc(NC(=O)c2c(Cn3ccc4cnccc43)ccc3ccccc23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL205138
Phase Preclinical
Structure Type MOL
InChI Key QBLUCJVUCLKJOT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

433.6
MW (Da)
6.79
ALogP
3
HBA
1
HBD
46.9
PSA (Ų)
0.34
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H27N3O
MW 433.56
Aromatic Rings 5
Heavy Atoms 33
NP-Likeness -1.39

Literature References

PubMed DOI Target Context # Activities
16364640 10.1016/j.bmcl.2005.11.105 Vascular endothelial growth factor receptor 2 2
16364640 10.1016/j.bmcl.2005.11.105 Vascular endothelial growth factor receptor 1 1

Data from ChEMBL 36 via Core Engine