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Name | CHEMBL49262 |
---|---|
Molecular formula | C25H27N5O3 |
IUPAC name | ethyl (2E)-2-[4,4-dimethyl-6-oxo-1-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]piperidin-2-ylidene]acetate |
Molecular weight | 445.523 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.6 |
Synonyms | BDBM50280324 [4,4-Dimethyl-6-oxo-1-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-piperidin-(2E)-ylidene]-acetic acid ethyl ester |
Inchi Key | CGVJXFIUZVKUIC-CPNJWEJPSA-N |
Inchi ID | InChI=1S/C25H27N5O3/c1-4-33-23(32)13-19-14-25(2,3)15-22(31)30(19)16-17-9-11-18(12-10-17)20-7-5-6-8-21(20)24-26-28-29-27-24/h5-13H,4,14-16H2,1-3H3,(H,26,27,28,29)/b19-13+ |
PubChem CID | 44295010 |
ChEMBL | CHEMBL49262 |
IUPHAR | N/A |
BindingDB | 50280324 |
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 |
---|---|---|---|---|---|
41641 | Type-1 angiotensin II receptor | P34976 | AGTR1 | Oryctolagus cuniculus (Rabbit) | 359 |
41642 | Type-1 angiotensin II receptor | P25104 | AGTR1 | Bos taurus (Bovine) | 359 |
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