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| Name | CHEMBL338101 |
|---|---|
| Molecular formula | C37H37Cl2N5O5S |
| IUPAC name | N-butyl-3-[3-butyl-4-[[4-[2-[(2-chlorobenzoyl)sulfamoyl]phenyl]phenyl]methyl]-5-oxo-1,2,4-triazol-1-yl]-4-chlorobenzamide |
| Molecular weight | 734.693 |
| Hydrogen bond acceptor | 6 |
| Hydrogen bond donor | 2 |
| XlogP | 7.8 |
| Synonyms | N-Butyl-3-{3-butyl-4-[2''-(2-chloro-benzoylsulfamoyl)-biphenyl-4-ylmethyl]-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl}-4-chloro-benzamide N-Butyl-4-chloro-3-[[3-butyl-4,5-dihydro-5-oxo-4-[[2'-[(2-chlorobenzoyl)sulfamoyl]biphenyl-4-yl]methyl]-1H-1,2,4-triazol]-1-yl]benzamide BDBM50030731 DDRMQVVVNMEVAD-UHFFFAOYSA-N 5-n-Butyl-2-[5-(N-n-butylcarbamoyl)-2-chlorophenyl]-4-[[2'-[N-(2-chlorobenzoyl)sulfamoyl]biphenyl-4-yl]methyl]-2,4-dihydro-3H-1,2,4-triazol-3one [ Show all ] |
| Inchi Key | DDRMQVVVNMEVAD-UHFFFAOYSA-N |
| Inchi ID | InChI=1S/C37H37Cl2N5O5S/c1-3-5-15-34-41-44(32-23-27(20-21-31(32)39)35(45)40-22-6-4-2)37(47)43(34)24-25-16-18-26(19-17-25)28-11-8-10-14-33(28)50(48,49)42-36(46)29-12-7-9-13-30(29)38/h7-14,16-21,23H,3-6,15,22,24H2,1-2H3,(H,40,45)(H,42,46) |
| PubChem CID | 10485116 |
| ChEMBL | CHEMBL338101 |
| IUPHAR | N/A |
| BindingDB | 50030731 |
| DrugBank | N/A |
Structure |  |
| Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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| GLASS ID | Name | UniProt | Gene | Species | Length |
|---|---|---|---|---|---|
| 57387 | Type-1 angiotensin II receptor | P34976 | AGTR1 | Oryctolagus cuniculus (Rabbit) | 359 |
| 57388 | Type-2 angiotensin II receptor | P35351 | Agtr2 | Rattus norvegicus (Rat) | 363 |
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