Ligand |
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Ligand Name: 2-deoxy-2-fluoro-5-O-thiophosphono-alpha-D-arabinofuranose | ||
Ligand Type: saccharide | ||
Ligand ID: COVPDB219 | PubChem: 54669589 | |
Synonym(s):
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DrugBank: - | ChEMBL: - | |
Canonical SMILES: O[C@H]1O[C@H](COP(O)(S)=O)[C@@H](O)[C@@H]1F | ||
Standard InChI: InChI=1S/C5H10FO6PS/c6-3-4(7)2(12-5(3)8)1-11-13(9,10)14/h2-5,7-8H,1H2,(H2,9,10,14)/t2-,3+,4-,5+/m1/s1 | ||
Molecular Formula: C5H10FO6PS | Mol. Weight: 247.99197 | logP: -0.5506 |
HBD: 4 | HBA: 5 | |
#Rotatable Bonds: 3 | TPSA: 96.22 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 | P28907 (CD38_HUMAN) | Homo sapiens (Human) | 3ROM | 48Z |
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