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Compound Detail

CHEMBL3799549

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Cc1cc(Cl)cc2c1NC(=O)/C2=C1\Nc2ccccc2C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3799549
Phase Preclinical
Structure Type MOL
InChI Key ZPHLLQOZLTUSKY-SQFISAMPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

310.7
MW (Da)
3.62
ALogP
3
HBA
2
HBD
58.2
PSA (Ų)
0.73
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H11ClN2O2
MW 310.74
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.02

Literature References

PubMed DOI Target Context # Activities
27106709 10.1016/j.bmcl.2016.03.111 Serine/threonine-protein kinase 17B 1

Data from ChEMBL 36 via Core Engine