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Name | CHEMBL374251 |
---|---|
Molecular formula | C26H20F3N7O4 |
IUPAC name | N-[(2R)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-[2-oxo-3-[4-(trifluoromethyl)pyrimidin-2-yl]benzimidazol-1-yl]acetamide |
Molecular weight | 551.486 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 2.0 |
Synonyms | N-[(4R)-3-methyl-2,5-dioxo-1'',3''-dihydrospiro[imidazolidine-4,2''-indene]-5''-yl]-2-{2-oxo-3-[4-(trifluoromethyl)pyrimidin-2-yl]-2,3-dihydro-1H-1,3-benzodiazol-1-yl}acetamide BDBM50195952 |
Inchi Key | CBYMKRJSUMRSHK-RUZDIDTESA-N |
Inchi ID | InChI=1S/C26H20F3N7O4/c1-34-23(39)33-21(38)25(34)11-14-6-7-16(10-15(14)12-25)31-20(37)13-35-17-4-2-3-5-18(17)36(24(35)40)22-30-9-8-19(32-22)26(27,28)29/h2-10H,11-13H2,1H3,(H,31,37)(H,33,38,39)/t25-/m1/s1 |
PubChem CID | 44420250 |
ChEMBL | CHEMBL374251 |
IUPHAR | N/A |
BindingDB | 50195952 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
38342 | Calcitonin gene-related peptide type 1 receptor | Q16602 | CALCRL | Homo sapiens (Human) | 461 |
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