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| Ligand Name: 4-[[(3~{S})-1-oxidanyl-3,4-dihydro-2,1-benzoxaborinin-3-yl]methylamino]benzenecarboximidamide |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB1064 |
PubChem:
- |
| Synonym(s):
-
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: NC(=N)c1ccc(NC[C@@H]2Cc3ccccc3B(O)O2)cc1 |
| Standard InChI: InChI=1S/C16H18BN3O2/c18-16(19)11-5-7-13(8-6-11)20-10-14-9-12-3-1-2-4-15(12)17(21)22-14/h1-8,14,20-21H,9-10H2,(H3,18,19)/t14-/m0/s1 |
| Molecular Formula: C16H18BN3O2 |
Mol. Weight: 295.1492 |
logP: 0.71157 |
| HBD: 4 | HBA: 4 |
| #Rotatable Bonds: 4 | TPSA: 91.36 |