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Name | 4-Bromobenzyl benzoate |
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Molecular formula | C14H11BrO2 |
IUPAC name | (4-bromophenyl)methyl benzoate |
Molecular weight | 291.144 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 0 |
XlogP | 4.7 |
Synonyms | ZINC6595501 Benzoic acid 4-bromobenzyl ester CHEMBL449299 ZXNNWLRBSJBCPS-UHFFFAOYSA-N Benzoic acid, (4-bromophenyl)methyl ester [ Show all ] |
Inchi Key | ZXNNWLRBSJBCPS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H11BrO2/c15-13-8-6-11(7-9-13)10-17-14(16)12-4-2-1-3-5-12/h1-9H,10H2 |
PubChem CID | 44587066 |
ChEMBL | CHEMBL449299 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
439931 | Type-1A angiotensin II receptor | P29754 | Agtr1a | Mus musculus (Mouse) | 359 |
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