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Compound Detail

CHEMBL105912

RASPBERRYKETONE
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CC(=O)CCc1ccc(O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL105912
Name RASPBERRYKETONE
Phase Preclinical
Structure Type MOL
InChI Key NJGBTKGETPDVIK-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

164.2
MW (Da)
1.91
ALogP
2
HBA
1
HBD
37.3
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C10H12O2
MW 164.20
Aromatic Rings 1
Heavy Atoms 12
NP-Likeness 0.60

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
20226658 10.1016/j.bmcl.2010.02.059 Androgen receptor 4
21353549 10.1016/j.bmcl.2011.02.003 C6 2
- 10.1016/S0960-894X(97)10147-0 K562 1
20226658 10.1016/j.bmcl.2010.02.059 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine