Ligand |
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Ligand Name: (E)-N-ethyl-4-oxo-4-phenylbut-2-enamide | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB1191 | PubChem: 135391299 | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: CCNC(=O)/C=C/C(=O)c1ccccc1 | ||
Standard InChI: InChI=1S/C12H13NO2/c1-2-13-12(15)9-8-11(14)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H,13,15)/b9-8+ | ||
Molecular Formula: C12H13NO2 | Mol. Weight: 203.09464 | logP: 1.5616 |
HBD: 1 | HBA: 2 | |
#Rotatable Bonds: 4 | TPSA: 46.17 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Queuine tRNA-ribosyltransferase | P28720 (TGT_ZYMMO) | Zymomonas mobilis subsp. mobilis (strain ATCC 31821 / ZM4 / CP4) | 6YGV | OQH |
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