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Name | CHEMBL325445 |
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Molecular formula | C25H28N2O4 |
IUPAC name | 2-[4-[(2-butyl-4-oxo-8-oxa-1,3-diazaspiro[4.5]dec-1-en-3-yl)methyl]phenyl]benzoic acid |
Molecular weight | 420.509 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.6 |
Synonyms | 4'-[[(2-Butyl-4-oxo-1,3-diaza-8-oxaspiro[4.5]dec-1-en)-3-yl]methyl]-1,1'-biphenyl-2-carboxylic acid 4''-(2-Butyl-4-oxo-8-oxa-1,3-diaza-spiro[4.5]dec-1-en-3-ylmethyl)-biphenyl-2-carboxylic acid BDBM50042248 |
Inchi Key | GVGMYCZEPTXGBF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H28N2O4/c1-2-3-8-22-26-25(13-15-31-16-14-25)24(30)27(22)17-18-9-11-19(12-10-18)20-6-4-5-7-21(20)23(28)29/h4-7,9-12H,2-3,8,13-17H2,1H3,(H,28,29) |
PubChem CID | 44341792 |
ChEMBL | CHEMBL325445 |
IUPHAR | N/A |
BindingDB | 50042248 |
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 |
---|---|---|---|---|---|
106239 | Type-1B angiotensin II receptor | P29089 | Agtr1b | Rattus norvegicus (Rat) | 359 |
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