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| Ligand Name: (phenylmethylsulfonylamino)methylboronic acid |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB580 |
PubChem:
49837085
|
Synonym(s):
- {[(benzylsulfonyl)amino]methyl}boronic acid
- chembl1231476
- (benzylsulfonylamino)methylboronic acid
- pinacol(phenylmethanesulfonylamino)methaneboronate
- cr23
- schembl14861700
- 3o86
- bdbm50330784
- q27458533
show 8 synonym(s)
|
| DrugBank: - |
ChEMBL: CHEMBL1231476 |
| Canonical SMILES: OB(O)CNS(=O)(=O)Cc1ccccc1 |
| Standard InChI: InChI=1S/C8H12BNO4S/c11-9(12)7-10-15(13,14)6-8-4-2-1-3-5-8/h1-5,10-12H,6-7H2 |
| Molecular Formula: C8H12BNO4S |
Mol. Weight: 229.05801 |
logP: -0.882 |
| HBD: 3 | HBA: 4 |
| #Rotatable Bonds: 5 | TPSA: 86.63 |