Bioactive Compound Details

BioIDbio1639
NameBETHANIDINE SULFATE
ChEMBL IDCHEMBL2110368
Molecular FormulaC20H32N6O4S
Molecular Weight452.58
Molecular Weight (Monoisotopic)177.1266
TypeSmall molecule
Max PhasePhase 4
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsBENDOGEN|BETANIDINE SULFATE|BETANIDINE SULPHATE|BETHANIDINE SULFATE|BETHANIDINE SULPHATE|BW-467-C-60|ESBATAL|NSC-106563|TENATHAN
SmilesC/N=C(\NC)NCc1ccccc1.C/N=C(\NC)NCc1ccccc1.O=S(=O)(O)O
InchiInChI=1S/2C10H15N3.H2O4S/c2*1-11-10(12-2)13-8-9-6-4-3-5-7-9;1-5(2,3)4/h2*3-7H,8H2,1-2H3,(H2,11,12,13);(H2,1,2,3,4)
Inchi KeyYTIJUXVIZLYQTB-UHFFFAOYSA-N
Molecular SpeciesBASE
TargetsNone
BioactivitiesNone
Np Likeness Score-0.96
Records Key['BETHANIDINE SULFATE', 'BETHANIDINE SULFATE', 'BETHANIDINE SULFATE']
Records Name['BETHANIDINE SULFATE', 'BETHANIDINE SULFATE', 'BETHANIDINE SULFATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure