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Ligand Name: {4-[(azetidin-1-yl)sulfonyl]phenyl}boronic acid |
Ligand Type: non-polymer |
Ligand ID: COVPDB1004 |
PubChem:
44886919
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Synonym(s):
- 871329-68-9
- 4-(azetidin-1-ylsulfonyl)phenylboronic acid
- (4-(azetidin-1-ylsulfonyl)phenyl)boronic acid
- 4-(1-azetidinylsulfonyl)phenylboronic acid
- mfcd07363756
- [4-(azetidine-1-sulfonyl)phenyl]boronic acid
- [4-(azetidin-1-ylsulfonyl)phenyl]boronic acid
- acmc-209qgc
- boronic acid,b-[4-(1-azetidinylsulfonyl)phenyl]-
- schembl289460
- dtxsid10661207
- anw-38554
- akos015854059
- zinc169745098
- ab30701
- db-114203
- ft-0687799
- x2612
- b-4343
show 18 synonym(s)
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DrugBank: - |
ChEMBL: - |
Canonical SMILES: OB(O)c1ccc(cc1)S(=O)(=O)N2CCC2 |
Standard InChI: InChI=1S/C9H12BNO4S/c12-10(13)8-2-4-9(5-3-8)16(14,15)11-6-1-7-11/h2-5,12-13H,1,6-7H2 |
Molecular Formula: C9H12BNO4S |
Mol. Weight: 241.05801 |
logP: -1.2392 |
HBD: 2 | HBA: 4 |
#Rotatable Bonds: 3 | TPSA: 77.84 |