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Name | 5-Butyl-1H-pyrazole-3-carboxylic acid |
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Molecular formula | C8H12N2O2 |
IUPAC name | 5-butyl-1H-pyrazole-3-carboxylic acid |
Molecular weight | 168.196 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 1.8 |
Synonyms | MolPort-002-026-457 ZJTXSGLJNBAMJS-UHFFFAOYSA-N 3-butylpyrazole-5-carboxylic acid AC1O5JK4 CHM0075795 [ Show all ] |
Inchi Key | ZJTXSGLJNBAMJS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C8H12N2O2/c1-2-3-4-6-5-7(8(11)12)10-9-6/h5H,2-4H2,1H3,(H,9,10)(H,11,12) |
PubChem CID | 6485181 |
ChEMBL | CHEMBL428730 |
IUPHAR | 1591 |
BindingDB | 50220842 |
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 |
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430201 | Hydroxycarboxylic acid receptor 2 | Q8TDS4 | HCAR2 | Homo sapiens (Human) | 363 |
430203 | Hydroxycarboxylic acid receptor 2 | Q80Z39 | Hcar2 | Rattus norvegicus (Rat) | 360 |
430202 | Hydroxycarboxylic acid receptor 3 | P49019 | HCAR3 | Homo sapiens (Human) | 387 |
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