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Compound Detail

CHEMBL1940263

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COc1cccc(S(=O)(=O)NCc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1940263
Phase Preclinical
Structure Type MOL
InChI Key DTHOTEZEHTUKLO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

481.5
MW (Da)
3.93
ALogP
8
HBA
1
HBD
108.9
PSA (Ų)
0.38
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H23N3O6S
MW 481.53
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -1.25

Literature References

PubMed DOI Target Context # Activities
22153662 10.1016/j.bmcl.2011.11.019 Platelet-derived growth factor receptor beta 1
22153662 10.1016/j.bmcl.2011.11.019 Vascular endothelial growth factor receptor 3 1
22153662 10.1016/j.bmcl.2011.11.019 Macrophage colony-stimulating factor 1 receptor 1
22153662 10.1016/j.bmcl.2011.11.019 Receptor-type tyrosine-protein kinase FLT3 1
22153662 10.1016/j.bmcl.2011.11.019 Platelet-derived growth factor receptor alpha 1

Data from ChEMBL 36 via Core Engine