Bioactive Compound Details

BioIDbio3210
NameELINZANETANT
ChEMBL IDCHEMBL4802157
Molecular FormulaC33H35F7N4O3
Molecular Weight668.65
Molecular Weight (Monoisotopic)668.2597
TypeSmall molecule
Max PhasePhase 3
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsBAY-3427080|BAY3427080|ELINZANETANT|NT-814
SmilesCc1cc(F)ccc1-c1cc(N2C[C@H]3COCCN3C[C@H]2CO)ncc1N(C)C(=O)C(C)(C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
InchiInChI=1S/C33H35F7N4O3/c1-19-9-23(34)5-6-26(19)27-13-29(44-16-25-18-47-8-7-43(25)15-24(44)17-45)41-14-28(27)42(4)30(46)31(2,3)20-10-21(32(35,36)37)12-22(11-20)33(38,39)40/h5-6,9-14,24-25,45H,7-8,15-18H2,1-4H3/t24-,25-/m0/s1
Inchi KeyDWRIJNIPBUFCQS-DQEYMECFSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-0.89
Records Key['ELINZANETANT', 'ELINZANETANT']
Records Name['ELINZANETANT', 'ELINZANETANT']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure