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Ligand Name: N-2-THIOPHEN-2-YL-ACETAMIDE BORONIC ACID |
Ligand Type: non-polymer |
Ligand ID: COVPDB657 |
PubChem:
2671
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Synonym(s):
- chembl320049
- 448211-54-9
- acylglycineboronic acid, 11
- lp04
- schembl12753869
- dtxsid80274383
- bdbm50115621
- db02094
- n-(dihydroxyborylmethyl)thiophene-2-acetamide
- (2-(thiophen-2-yl)acetamido)methylboronic acid
- [[2-(2-thienyl)acetyl]amino]methylboronic acid
- ((2-(thiophen-2-yl)acetamido)methyl)boronic acid
- {[(thiophen-2-ylacetyl)amino]methyl}boronic acid
- n-dihydroxyboranylmethyl-2-thiophen-2-yl-acetamide
- q27093166
show 14 synonym(s)
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DrugBank: DB02094 |
ChEMBL: CHEMBL320049 |
Canonical SMILES: OB(O)CNC(=O)Cc1cccs1 |
Standard InChI: InChI=1S/C7H10BNO3S/c10-7(9-5-8(11)12)4-6-2-1-3-13-6/h1-3,11-12H,4-5H2,(H,9,10) |
Molecular Formula: C7H10BNO3S |
Mol. Weight: 199.04744 |
logP: -0.5812 |
HBD: 3 | HBA: 4 |
#Rotatable Bonds: 4 | TPSA: 69.56 |