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Name | 5-phenethyl-1H-pyrazole-3-carboxylic Acid |
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Molecular formula | C12H12N2O2 |
IUPAC name | 5-(2-phenylethyl)-1H-pyrazole-3-carboxylic acid |
Molecular weight | 216.24 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 2.3 |
Synonyms | BDBM50132146 SCHEMBL1149172 AJ-64058 CTK7I6521 ZINC13526610 [ Show all ] |
Inchi Key | HHEBXMNODWRUEV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C12H12N2O2/c15-12(16)11-8-10(13-14-11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,13,14)(H,15,16) |
PubChem CID | 11830866 |
ChEMBL | CHEMBL129385 |
IUPHAR | N/A |
BindingDB | 50132146 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
114847 | Hydroxycarboxylic acid receptor 2 | Q80Z39 | Hcar2 | Rattus norvegicus (Rat) | 360 |
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