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Ligand · A1AKO

A1AKO · (4S)-3-(4-chlorophenyl)-N'-[(1E)-ethanimidoyl]-4-phenyl-N-[4-(trifluoromethyl)benzene-1-sulfonyl]-4,5-dihydro-1H-pyrazole-1-carboximidamide

A1AKO, (4S)-3-(4-chlorophenyl)-N'-[(1E)-ethanimidoyl]-4-phenyl-N-[4-(trifluoromethyl)benzene-1-sulfonyl]-4,5-dihydro-1H-pyrazole-1-carboximidamide (C25 H21 Cl F3 N5 O2 S, 548.0 g/mol), in the MolNFT structures on GenesisL1: bound in 1…

Component
A1AKO
Formula
C25 H21 Cl F3 N5 O2 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1AKO in 1 structure; the first of them:

  • 9B9Z · Structural mechanism of CB1R binding to peripheral and biased inverse agonists · A1AKO R1201 · binds PHE102, MET103, ASP104, ILE105, ILE119, LEU122, SER123, GLY166 and 13 more

Residues it binds most

PHE 1, ILE 1, MET 1, LEU 1, SER 1, ALA 1, ASP 1, CYS 1, GLY 1, THR 1 (residue and the binding sites it lines).

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