Bioactive Compound Details

BioIDbio200593
NameELUBRIXIN
ChEMBL IDCHEMBL2178579
Molecular FormulaC17H17Cl2FN4O4S
Molecular Weight463.32
Molecular Weight (Monoisotopic)462.0332
TypeSmall molecule
Max PhasePhase 2
Target IDTar81
Target NameNone
SynonymsELUBRIXIN|ELUBRIXINA|ELUBRIXINE|Elubrixin|SB-656933|SB-656933-AAF|SB656933
SmilesO=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCNCC2)c1O)Nc1cccc(F)c1Cl
InchiInChI=1S/C17H17Cl2FN4O4S/c18-10-4-5-13(23-17(26)22-12-3-1-2-11(20)14(12)19)15(25)16(10)29(27,28)24-8-6-21-7-9-24/h1-5,21,25H,6-9H2,(H2,22,23,26)
Inchi KeyYQYFEGTYCUQBEI-UHFFFAOYSA-N
Molecular SpeciesACID
Targets5.0
Bioactivities16.0
Np Likeness Score-1.7
Records Key['31, SB-656933', 'ELUBRIXIN', 'ELUBRIXIN', '3413', 'COVC-1745806240']
Records Name['1-(4-chloro-2-hydroxy-3-(piperazin-1-ylsulfonyl)phenyl)-3-(2-chloro-3-fluorophenyl)urea', 'ELUBRIXIN', 'ELUBRIXIN', None, 'ELUBRIXIN']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure