Ligand |
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Ligand Name: TA5 | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB1391 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: CCN[P@@](F)(=O)OCC | ||
Standard InChI: InChI=1S/C4H11FNO2P/c1-3-6-9(5,7)8-4-2/h3-4H2,1-2H3,(H,6,7)/t9-/m0/s1 | ||
Molecular Formula: C4H11FNO2P | Mol. Weight: 155.05115 | logP: 1.71 |
HBD: 1 | HBA: 2 | |
#Rotatable Bonds: 4 | TPSA: 38.33 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Cholinesterase | P06276 (CHLE_HUMAN) | Homo sapiens (Human) | 2WIJ | TN7 | Kd : 630000 nM | PDBBind | SHOW |