Ligand
Ligand Name:   2-(2-phosphono-ethyl)-acrylic acid 4-nitro-phenyl ester
Ligand Type:   non-polymer
Ligand ID:   COVPDB666 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   OP(O)(=O)CCC(=C)C(=O)Oc1ccc(cc1)[N+]([O-])=O
Standard InChI:   InChI=1S/C11H12NO7P/c1-8(6-7-20(16,17)18)11(13)19-10-4-2-9(3-5-10)12(14)15/h2-5H,1,6-7H2,(H2,16,17,18)
Molecular Formula:   C11H12NO7P Mol. Weight:   301.03513 logP:   1.6242
HBD:   2 HBA:   5
#Rotatable Bonds:   6 TPSA:   126.97

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Glyceraldehyde-3-phosphate dehydrogenase, glycosomal P22513 (G3PG_TRYCR) Trypanosoma cruzi 1ML3 CYX
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