Ligand |
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| Ligand Name: SN-GLYCEROL-1-PHOSPHATE | ||
| Canonical SMILES: OC[C@H](O)COP(O)(O)=O | ||
| Standard InChI: InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)/t3-/m0/s1 | ||
| HET Code: 1GP | PubChem: 439276 | |
| DrugBank: - | ChEMBL: CHEMBL1229736 | |
| Molecular Formula: C3H9O6P | Mol. Weight: 172.01367 | logP: -1.5511 |
| HBD: 4 | HBA: 4 | |
| #Rotatable Bonds: 4 | TPSA: 107.22 | |
Covalent Mechanism |
Reaction Name | Residue | Chain ID | SASA | pKa | Warhead Name | Warhead Structure |
| Nucleophilic Acyl Substitution | GLU 1167 | A | 11.78 | 6.92 | Hemiacetal |  |
Binding Affinity |
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- |