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| Ligand Name: (~{E})-3-[2-(dihydroxyboranyl)phenyl]prop-2-enoic acid |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB337 |
PubChem:
6158001
|
Synonym(s):
- 374105-86-9
- 2-(2-carboxyvinyl)benzeneboronic acid
- 3-(2-boronophenyl)acrylic acid
- (e)-3-(2-boronophenyl)prop-2-enoic acid
- mfcd02093067
- (e)-3-(2-boronophenyl)acrylic acid
- 2-boronocinnamic acid
- 2-(2-carboxyvinyl)benzeneboronicacid
- schembl2561004
- akos004116398
- akos025293533
- zinc169747029
- ab10755
- 4-methylquinoline-2-carboxylicacid
- as-60359
- (e)-3-(2-boronophenyl)-2-propenoic acid
- 105c869
- a823636
- (e)-3-[2-(dihydroxyboranyl)phenyl]prop-2-enoic acid
- (2e)-3-[2-(dihydroxyboranyl)phenyl]prop-2-enoic acid
- 1200806-17-2
show 20 synonym(s)
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: OB(O)c1ccccc1\C=C\C(O)=O |
| Standard InChI: InChI=1S/C9H9BO4/c11-9(12)6-5-7-3-1-2-4-8(7)10(13)14/h1-6,13-14H,(H,11,12)/b6-5+ |
| Molecular Formula: C9H9BO4 |
Mol. Weight: 192.05939 |
logP: -0.5358 |
| HBD: 3 | HBA: 3 |
| #Rotatable Bonds: 3 | TPSA: 77.76 |