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Compound Detail

CHEMBL207008

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COc1ccc2[nH]c(Cc3cc4ccccc4[nH]3)cc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL207008
Phase Preclinical
Structure Type MOL
InChI Key OBQMSVPFIAYPQJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

276.3
MW (Da)
4.25
ALogP
1
HBA
2
HBD
40.8
PSA (Ų)
0.58
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 C18H16N2O
MW 276.34
Aromatic Rings 4
Heavy Atoms 21
NP-Likeness -0.50

Literature References

PubMed DOI Target Context # Activities
16722630 10.1021/jm058033i Platelet-derived growth factor receptor 1
16722630 10.1021/jm058033i Receptor-type tyrosine-protein kinase FLT3 1

Data from ChEMBL 36 via Core Engine