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| Ligand Name: Vaborbactam |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB224 |
PubChem:
56649692
|
Synonym(s):
- rpx-7009
- 1360457-46-0
- rpx7009
- unii-1c75676f8v
- 2-((3r,6s)-2-hydroxy-3-(2-(thiophen-2-yl)acetamido)-1,2-oxaborinan-6-yl)acetic acid
- chembl3317857
- 1c75676f8v
- 2-[(3r,6s)-2-hydroxy-3-[(2-thiophen-2-ylacetyl)amino]oxaborinan-6-yl]acetic acid
- vaborbactam [inn]
- rpx 7009
- vaborbactam. rpx7009
- vaborbactam (usan/inn)
- vaborbactam [usan:inn]
- schembl620289
- gtpl10871
- vabomere (vaborbactam + meropenem)
- ex-a2589
- bdbm50089084
- mfcd28502176
- akos032961376
- cs-6445
- db12107
- sb17184
- 1,2-oxaborinane-6-acetic acid, 2-hydroxy-3-((2-(2-thienyl)acetyl)amino)-, (3r,6s)-
- compound 9f [pmid: 25782055]
- ncgc00510003-01
- (3r,6s)-
- hy-19930
- 2-hydroxy-3-((2-(2-thienyl)acetyl)amino)-
- d10998
- q27252228
- {(3r,6s)-2-hydroxy-3-[(thiophen-2-ylacetyl)amino]-1,2-oxaborinan-6-yl}acetic acid; 2-((3r,6s)-2-hydroxy-3-(2-(thiophen-2-yl)acetamido)-1,2-oxaborinan-6-yl)acetic acid; 2-[(3r,6s)-2-hydroxy-3-[(2-thiophen-2-ylacetyl)amino]oxaborinan-6-yl]acetic acid; 1,2-oxaborinane-6-acetic acid
show 31 synonym(s)
|
| DrugBank: DB12107 |
ChEMBL: CHEMBL3317857 |
| Canonical SMILES: OB1O[C@H](CC(O)=O)CC[C@@H]1NC(=O)Cc1cccs1 |
| Standard InChI: InChI=1S/C12H16BNO5S/c15-11(7-9-2-1-5-20-9)14-10-4-3-8(6-12(16)17)19-13(10)18/h1-2,5,8,10,18H,3-4,6-7H2,(H,14,15)(H,16,17)/t8-,10-/m0/s1 |
| Molecular Formula: C12H16BNO5S |
Mol. Weight: 297.08423 |
logP: 0.4488 |
| HBD: 3 | HBA: 5 |
| #Rotatable Bonds: 5 | TPSA: 95.86 |