BDBM24424 (3R,5R)-7-[3-(benzylcarbamoyl)-2-(propan-2-yl)-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl]-3,5-dihydroxyheptanoic acid::Bicyclic Pyrrole Series 3 Compound, 11

SMILES CC(C)c1c(C(=O)NCc2ccccc2)c2CCCCCc2n1CC[C@@H](O)C[C@@H](O)CC(O)=O

InChI Key InChIKey=OHZSHBMDEVHSIV-NHCUHLMSSA-N

Data  1 ITC

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 24424   

Cell3-hydroxy-3-methylglutaryl-coenzyme A reductase (HMG-CoA)(Homo sapiens (Human))
Boehringer Ingelheim Pharmaceuticals

SyringePNGBDBM24424((3R,5R)-7-[3-(benzylcarbamoyl)-2-(propan-2-yl)-1H,...)
ITC DataΔG°: -9.98kcal/mole −TΔS°: -3.10kcal/mole ΔH°: -6.89kcal/mole logk: 1.60E+7
pH: 7.2 T: 30.00°C