Ligand
Ligand Name:   SAR127303
Ligand Type:   non-polymer
Ligand ID:   COVPDB294 PubChem:   54761543
Synonym(s):  
  •   chembl4215558
  • 1,1,1,3,3,3-hexafluoropropan-2-yl 4-(((4-chlorophenyl)sulfonamido)methyl)piperidine-1-carboxylate
  • 1352011-38-1
  • schembl14834237
  • bdbm50450707
  • 1,1,1,3,3,3-hexafluoropropan-2-yl 4-[[(4-chlorophenyl)sulfonylamino]methyl]piperidine-1-carboxylate
show 5 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL4215558
Canonical SMILES:   FC(F)(F)C(C(F)(F)F)OC(=O)N1CCC(CC1)CNS(=O)(=O)c2ccc(Cl)cc2
Standard InChI:   InChI=1S/C16H17ClF6N2O4S/c17-11-1-3-12(4-2-11)30(27,28)24-9-10-5-7-25(8-6-10)14(26)29-13(15(18,19)20)16(21,22)23/h1-4,10,13,24H,5-9H2
Molecular Formula:   C16H17ClF6N2O4S Mol. Weight:   482.05017 logP:   3.9601
HBD:   1 HBA:   4
#Rotatable Bonds:   5 TPSA:   75.71

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Monoglyceride lipase Q99685 (MGLL_HUMAN) Homo sapiens (Human) 4UUQ 64D IC50 : 29 nM PDBBind SHOW