Ligand
Ligand Name:   7-phenyl-1-[4-(pyridin-2-yl)-1,3-oxazol-2-yl]heptan-1-one
Ligand Type:   non-polymer
Ligand ID:   COVPDB1297 PubChem:   44554611
Synonym(s):  
  •   chembl461541
  • schembl2163000
  • bdbm50247074
  • 7-phenyl-1-(4-(pyridin-2-yl)oxazol-2-yl)heptan-1-one
  • 7-phenyl-1-(4-pyridin-2-yl-1,3-oxazol-2-yl)heptan-1-one
show 4 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL461541
Canonical SMILES:   c1cccnc1-c2coc(n2)C(=O)CCCCCCc3ccccc3
Standard InChI:   InChI=1S/C21H22N2O2/c24-20(14-7-2-1-4-10-17-11-5-3-6-12-17)21-23-19(16-25-21)18-13-8-9-15-22-18/h3,5-6,8-9,11-13,15-16H,1-2,4,7,10,14H2
Molecular Formula:   C21H22N2O2 Mol. Weight:   334.16812 logP:   5.1125
HBD:   0 HBA:   4
#Rotatable Bonds:   9 TPSA:   55.99

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Fatty-acid amide hydrolase 1 P97612 (FAAH1_RAT) Rattus norvegicus (Rat) 2WJ1 S99 Ki : 1.9 nM PDBBind SHOW