Bioactive Compound Details

BioIDbio385
NameSPONGIADIOXIN C
ChEMBL IDCHEMBL185753
Molecular FormulaC12H5Br3O3
Molecular Weight436.88
Molecular Weight (Monoisotopic)433.7789
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsSpongiadioxin C
SmilesOc1cc(Br)cc2c1Oc1cc(Br)cc(Br)c1O2
InchiInChI=1S/C12H5Br3O3/c13-5-1-7(15)11-9(3-5)18-12-8(16)2-6(14)4-10(12)17-11/h1-4,16H
Inchi KeyXZPITRJUKODSMI-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities5.0
Np Likeness Score0.85
Records Key['4a', '1']
Records Name['3,6,8-Tribromo-dibenzo[1,4]dioxin-1-ol', 'Spongiadioxin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure