Bioactive Compound Details

BioIDbio197154
NameNone
ChEMBL IDCHEMBL213490
Molecular FormulaC20H20O7P2
Molecular Weight434.32
Molecular Weight (Monoisotopic)434.0684
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms(1-HYDROXY-1-PHOSPHONO-2-[1,1';3',1'']TERPHENYL-3-YL-ETHYL)-PHOSPHONIC ACID
SmilesO=P(O)(O)C(O)(Cc1cccc(-c2cccc(-c3ccccc3)c2)c1)P(=O)(O)O
InchiInChI=1S/C20H20O7P2/c21-20(28(22,23)24,29(25,26)27)14-15-6-4-9-17(12-15)19-11-5-10-18(13-19)16-7-2-1-3-8-16/h1-13,21H,14H2,(H2,22,23,24)(H2,25,26,27)
Inchi KeyYXQQNSYZOQHKHD-UHFFFAOYSA-N
Molecular SpeciesACID
Targets6.0
Bioactivities13.0
Np Likeness Score0.02
Records Key['58', 'BPH-608', '31']
Records Name['1-hydroxy-2-[3-(3-phenylphenyl)phenyl]ethylidene-1,1-bisphosphonic acid', (1-hydroxy-1-phosphono-2-[1,1',3',1'']terphenyl-3''-yl-ethyl)-phosphonic acid", "(1-Hydroxy-1-phosphono-2-[1,1',3',1'']terphenyl-3-yl-ethyl)-phosphonic acid"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure