BDBM24435 (3R,5R)-7-[3-(4-fluorophenyl)-8-oxo-7-phenyl-1-(propan-2-yl)-1H,4H,5H,6H,7H,8H-pyrrolo[2,3-c]azepin-2-yl]-3,5-dihydroxyheptanoic acid::Pyrrole Series 5 Compound, 22

SMILES CC(C)n1c(CC[C@@H](O)C[C@@H](O)CC(O)=O)c(c2CCCN(c3ccccc3)C(=O)c12)-c1ccc(F)cc1

InChI Key InChIKey=OMBVEVHRIQULKW-DNQXCXABSA-N

Data  1 ITC

PDB links: 1 PDB ID matches this monomer.

  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 = 24435   

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

SyringePNGBDBM24435((3R,5R)-7-[3-(4-fluorophenyl)-8-oxo-7-phenyl-1-(pr...)
ITC DataΔG°: -10.6kcal/mole −TΔS°: -2.69kcal/mole ΔH°: -7.89kcal/mole logk: 4.63E+7
pH: 7.2 T: 30.00°C