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Name | CHEMBL66173 |
---|---|
Molecular formula | C26H31N7O3 |
IUPAC name | methyl 5-[3-butyl-5-oxo-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-1-yl]pentanoate |
Molecular weight | 489.58 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.8 |
Synonyms | 4-[[2'-(1H-Tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl]-4,5-dihydro-3-butyl-5-oxo-1H-1,2,4-triazole-1-pentanoic acid methyl ester BDBM50044334 L006298 5-{3-Butyl-5-oxo-4-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-4,5-dihydro-[1,2,4]triazol-1-yl}-pentanoic acid methyl ester SCHEMBL7396576 |
Inchi Key | BQUFIDVGYDHRKS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H31N7O3/c1-3-4-11-23-29-33(17-8-7-12-24(34)36-2)26(35)32(23)18-19-13-15-20(16-14-19)21-9-5-6-10-22(21)25-27-30-31-28-25/h5-6,9-10,13-16H,3-4,7-8,11-12,17-18H2,1-2H3,(H,27,28,30,31) |
PubChem CID | 14951067 |
ChEMBL | CHEMBL66173 |
IUPHAR | N/A |
BindingDB | 50044334 |
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 |
---|---|---|---|---|---|
30655 | Type-1B angiotensin II receptor | P29089 | Agtr1b | Rattus norvegicus (Rat) | 359 |
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