Ligand |
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| Ligand Name: [(2-AMINO-ALPHA-METHOXYIMINO-4-THIAZOLYLACETYL)AMINO]METHYLBORONIC ACID | ||
| Ligand Type: non-polymer | ||
| Ligand ID: COVPDB663 | PubChem: 6323277 | |
Synonym(s):
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| DrugBank: - | ChEMBL: CHEMBL3347499 | |
| Canonical SMILES: OB(O)CNC(=O)/C(=N\OC)c1csc(n1)N | ||
| Standard InChI: InChI=1S/C7H11BN4O4S/c1-16-12-5(4-2-17-7(9)11-4)6(13)10-3-8(14)15/h2,14-15H,3H2,1H3,(H2,9,11)(H,10,13)/b12-5- | ||
| Molecular Formula: C7H11BN4O4S | Mol. Weight: 258.05942 | logP: -1.796 |
| HBD: 4 | HBA: 8 | |
| #Rotatable Bonds: 5 | TPSA: 130.06 | |