Ligand
Ligand Name:   6-[2-(3-biphenyl-4-ylpropanoyl)-1,3-oxazol-5-yl]pyridine-2-carboxylic acid
Ligand Type:   non-polymer
Ligand ID:   COVPDB781 PubChem:   24799115
Synonym(s):  
  •   chembl260747
  • schembl2773471
  • bdbm50233957
  • q27460119
  • 6-(2-(3-(biphenyl-4-yl)propanoyl)oxazol-5-yl)picolinate
  • 6-(2-(3-(biphenyl-4-yl)propanoyl)oxazol-5-yl)picolinic acid
  • 6-[2-[3-(4-phenylphenyl)propanoyl]-1,3-oxazol-5-yl]pyridine-2-carboxylic acid
  • 6-{2-[3-(biphenyl-4-yl)propanoyl]-1,3-oxazol-5-yl}pyridine-2-carboxylic acid
show 7 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL260747
Canonical SMILES:   OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccccc1
Standard InChI:   InChI=1S/C24H18N2O4/c27-21(14-11-16-9-12-18(13-10-16)17-5-2-1-3-6-17)23-25-15-22(30-23)19-7-4-8-20(26-19)24(28)29/h1-10,12-13,15H,11,14H2,(H,28,29)
Molecular Formula:   C24H18N2O4 Mol. Weight:   398.12665 logP:   4.9173
HBD:   1 HBA:   5
#Rotatable Bonds:   7 TPSA:   93.29

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) 3K83 F27 Ki : 22 nM, IC50 : 6 nM BindingDB SHOW
Fatty-acid amide hydrolase 1 P97612 (FAAH1_RAT) Rattus norvegicus (Rat) 3K83 F27 Ki : 22 nM Binding MOAD SHOW