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Ligand · S94

S94 · 4-phenoxy-N-[(1S,2R)-2-phenylcyclopropyl]piperidine-1-carboxamide

S94, 4-phenoxy-N-[(1S,2R)-2-phenylcyclopropyl]piperidine-1-carboxamide (C21 H24 N2 O2, 336.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
S94
Formula
C21 H24 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

S94 in 2 structures; the first of them:

  • 4X6Y · Human soluble epoxide hydrolase in complex with a cyclopropyl urea derivative · S94 A601 · binds PHE267, PRO268, ASP335, TRP336, MET339, THR360, TYR383, GLN384 and 10 more
  • 4X6Y · Human soluble epoxide hydrolase in complex with a cyclopropyl urea derivative · S94 A601 · binds PHE267, PRO268, ASP335, TRP336, MET339, THR360, TYR383, GLN384 and 10 more

Residues it binds most

LEU 4, MET 4, PHE 4, TRP 4, TYR 4, ASP 4, GLN 4, HIS 4, PRO 4, VAL 4 (residue and the binding sites it lines).

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