Ligand
Ligand Name:   (S)-(methyl 4-nitrophenyl [(R)-methoxy(phenyl)methyl]phosphonate)
Ligand Type:   non-polymer
Ligand ID:   COVPDB935 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   c1ccccc1[C@H](OC)[P@](=O)(OC)Oc2ccc([N+]([O-])=O)cc2
Standard InChI:   InChI=1S/C15H16NO6P/c1-20-15(12-6-4-3-5-7-12)23(19,21-2)22-14-10-8-13(9-11-14)16(17)18/h3-11,15H,1-2H3/t15-,23+/m1/s1
Molecular Formula:   C15H16NO6P Mol. Weight:   337.07153 logP:   4.1583
HBD:   0 HBA:   6
#Rotatable Bonds:   7 TPSA:   87.9

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Lipase 1 P20261 (LIP1_DIURU) Diutina rugosa (Yeast) (Candida rugosa) 3RAR IAN
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