Ligand |
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| Ligand Name: tetramethylazodicarboxamide | ||
| Canonical SMILES: CN(C)C(=O)/N=N/C(=O)N(C)C | ||
| Standard InChI: InChI=1S/C6H12N4O2/c1-9(2)5(11)7-8-6(12)10(3)4/h1-4H3/b8-7+ | ||
| HET Code: LSY | PubChem: 4278 | |
| DrugBank: - | ChEMBL: CHEMBL1338900 | |
| Molecular Formula: C6H12N4O2 | Mol. Weight: 172.09602 | logP: 0.8018 |
| HBD: 0 | HBA: 2 | |
| #Rotatable Bonds: 0 | TPSA: 65.34 | |
Covalent Mechanism |
Reaction Name | Residue | Chain ID | SASA | pKa | Warhead Name | Warhead Structure |
| Nucleophilic Addition to a Double Bond | CYS 107 | A | 88.13 | 9.67 | Hydrazide |  |
Binding Affinity |
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