Ligand |
||
 | ||
| Ligand Name: 1-{[hydroxy(phosphonooxy)boranyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid | ||
| Ligand Type: non-polymer | ||
| Ligand ID: COVPDB465 | PubChem: - | |
| Synonym(s): - | ||
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: OB(Cn1cc(nn1)C(O)=O)OP(O)(O)=O | ||
| Standard InChI: InChI=1S/C4H7BN3O7P/c9-4(10)3-1-8(7-6-3)2-5(11)15-16(12,13)14/h1,11H,2H2,(H,9,10)(H2,12,13,14) | ||
| Molecular Formula: C4H7BN3O7P | Mol. Weight: 251.01146 | logP: -1.8947 |
| HBD: 4 | HBA: 7 | |
| #Rotatable Bonds: 5 | TPSA: 155.0 | |