 |
| Ligand Name: (1R)-1-(2-THIENYLACETYLAMINO)-1-PHENYLMETHYLBORONIC ACID |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB1318 |
PubChem:
5289378
|
Synonym(s):
- chembl404155
- schembl1624497
- fp2807
- db08552
- [(r)-alpha-(2-thienylacetylamino)benzyl]boranic acid
- q27097752
- {(r)-phenyl[(thiophen-2-ylacetyl)amino]methyl}boronic acid
- [(r)-phenyl-[[2-(2-thienyl)acetyl]amino]methyl]boronic acid
show 7 synonym(s)
|
| DrugBank: DB08552 |
ChEMBL: CHEMBL404155 |
| Canonical SMILES: c1ccccc1[C@@H](B(O)O)NC(=O)Cc2cccs2 |
| Standard InChI: InChI=1S/C13H14BNO3S/c16-12(9-11-7-4-8-19-11)15-13(14(17)18)10-5-2-1-3-6-10/h1-8,13,17-18H,9H2,(H,15,16)/t13-/m0/s1 |
| Molecular Formula: C13H14BNO3S |
Mol. Weight: 275.07874 |
logP: 1.1601 |
| HBD: 3 | HBA: 4 |
| #Rotatable Bonds: 5 | TPSA: 69.56 |