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Name | CHEMBL327569 |
---|---|
Molecular formula | C33H28F3N5O4S |
IUPAC name | N-(1,3-benzoxazol-2-yl)-2-[4-[[3-butyl-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]benzenesulfonamide |
Molecular weight | 647.673 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 1 |
XlogP | 7.2 |
Synonyms | SCHEMBL9148088 4''-[3-Butyl-5-oxo-1-(2-trifluoromethyl-phenyl)-1,5-dihydro-[1,2,4]triazol-4-ylmethyl]-biphenyl-2-sulfonic acid benzooxazol-2-ylamide BDBM50039869 |
Inchi Key | BXRKFZIBTDBIGD-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C33H28F3N5O4S/c1-2-3-16-30-38-41(27-13-7-5-11-25(27)33(34,35)36)32(42)40(30)21-22-17-19-23(20-18-22)24-10-4-9-15-29(24)46(43,44)39-31-37-26-12-6-8-14-28(26)45-31/h4-15,17-20H,2-3,16,21H2,1H3,(H,37,39) |
PubChem CID | 10349256 |
ChEMBL | CHEMBL327569 |
IUPHAR | N/A |
BindingDB | 50039869 |
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 |
---|---|---|---|---|---|
35360 | Type-1 angiotensin II receptor | P34976 | AGTR1 | Oryctolagus cuniculus (Rabbit) | 359 |
35359 | Type-2 angiotensin II receptor | P35351 | Agtr2 | Rattus norvegicus (Rat) | 363 |
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