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| Name | CHEMBL313222 |
|---|---|
| Molecular formula | C29H31N7O |
| IUPAC name | 5-butyl-2-(3-phenylpropyl)-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-3-one |
| Molecular weight | 493.615 |
| Hydrogen bond acceptor | 5 |
| Hydrogen bond donor | 1 |
| XlogP | 5.6 |
| Synonyms | 5-Butyl-2-(3-phenyl-propyl)-4-[2''-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-2,4-dihydro-[1,2,4]triazol-3-one 4-[[2'-(1H-Tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl]-2-(3-phenylpropyl)-5-butyl-2H-1,2,4-triazol-3(4H)-one SCHEMBL7399866 5-Butyl-2-(3-phenyl-propyl)-4-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-2,4-dihydro-[1,2,4]triazol-3-one BDBM50044364 [ Show all ] |
| Inchi Key | CSQXFYGNSGJKRX-UHFFFAOYSA-N |
| Inchi ID | InChI=1S/C29H31N7O/c1-2-3-15-27-32-36(20-9-12-22-10-5-4-6-11-22)29(37)35(27)21-23-16-18-24(19-17-23)25-13-7-8-14-26(25)28-30-33-34-31-28/h4-8,10-11,13-14,16-19H,2-3,9,12,15,20-21H2,1H3,(H,30,31,33,34) |
| PubChem CID | 14956804 |
| ChEMBL | CHEMBL313222 |
| IUPHAR | N/A |
| BindingDB | 50044364 |
| 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 |
|---|---|---|---|---|---|
| 49657 | Type-1 angiotensin II receptor | P34976 | AGTR1 | Oryctolagus cuniculus (Rabbit) | 359 |
| 49658 | Type-1B angiotensin II receptor | P29089 | Agtr1b | Rattus norvegicus (Rat) | 359 |
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