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Name | 4-Isopropylbenzyl benzoate |
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Molecular formula | C17H18O2 |
IUPAC name | (4-propan-2-ylphenyl)methyl benzoate |
Molecular weight | 254.329 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 0 |
XlogP | 5.1 |
Synonyms | Benzoic acid 4-isopropylbenzyl ester CHEMBL525189 |
Inchi Key | OQURVZTUQABOQM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H18O2/c1-13(2)15-10-8-14(9-11-15)12-19-17(18)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3 |
PubChem CID | 44587224 |
ChEMBL | CHEMBL525189 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
248163 | Type-1A angiotensin II receptor | P29754 | Agtr1a | Mus musculus (Mouse) | 359 |
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