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| Ligand Name: 2, 3-(4-BENZENESULFONYL-THIOPHENE-2-SULFONYLAMINO)-PHENYLBORONIC ACID |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB770 |
PubChem:
1475
|
Synonym(s):
- 3-(4-benzenesulfonyl-thiophene-2-sulfonylamino)-phenylboronic acid
- chembl113381
- schembl4316537
- amide and sulfonamide derivatives, 2
- bdbm50115616
- db02858
- q27093820
- [3-({[4-(phenylsulfonyl)thiophen-2-yl]sulfonyl}amino)phenyl]boronic acid
- 3-(4-benzene-sulphonyl-thiophene-2-sulphonylamino)-phenylboronic acid
- 4-benzenesulfonyl-thiophene-2-sulfonic acid (3-dihydroxyboranyl-phenyl)-amide
show 9 synonym(s)
|
| DrugBank: DB02858 |
ChEMBL: CHEMBL113381 |
| Canonical SMILES: OB(O)c1cccc(NS(=O)(=O)c2cc(cs2)S(=O)(=O)c2ccccc2)c1 |
| Standard InChI: InChI=1S/C16H14BNO6S3/c19-17(20)12-5-4-6-13(9-12)18-27(23,24)16-10-15(11-25-16)26(21,22)14-7-2-1-3-8-14/h1-11,18-20H |
| Molecular Formula: C16H14BNO6S3 |
Mol. Weight: 423.00763 |
logP: 1.0615 |
| HBD: 3 | HBA: 7 |
| #Rotatable Bonds: 6 | TPSA: 120.77 |