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Compound Detail

CHEMBL64814

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CSc1c(C(=O)Nc2ccccc2)c2ccccc2n1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL64814
Phase Preclinical
Structure Type MOL
InChI Key NSWAGYPTXMCALG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

296.4
MW (Da)
4.15
ALogP
3
HBA
1
HBD
34.0
PSA (Ų)
0.74
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 C17H16N2OS
MW 296.39
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.06

Literature References

PubMed DOI Target Context # Activities
8027985 10.1021/jm00039a016 Epidermal growth factor receptor 1
8027985 10.1021/jm00039a016 Proto-oncogene tyrosine-protein kinase Src 1

Data from ChEMBL 36 via Core Engine