Bioactive Compound Details

BioIDbio2492
NameALTANSERIN TARTRATE
ChEMBL IDCHEMBL2448611
Molecular FormulaC26H28FN3O8S
Molecular Weight561.59
Molecular Weight (Monoisotopic)411.1417
TypeSmall molecule
Max PhaseUnknown
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsALTANSERIN TARTRATE|R-53,200|R-53200
SmilesO=C(O)C(O)C(O)C(=O)O.O=C(c1ccc(F)cc1)C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1
InchiInChI=1S/C22H22FN3O2S.C4H6O6/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29;5-1(3(7)8)2(6)4(9)10/h1-8,16H,9-14H2,(H,24,29);1-2,5-6H,(H,7,8)(H,9,10)
Inchi KeyVZGOQPXIRAHJLV-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-1.56
Records Key['ALTANSERIN TARTRATE']
Records Name['ALTANSERIN TARTRATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure