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Name | CHEMBL577304 |
---|---|
Molecular formula | C27H29F3N4O4 |
IUPAC name | 2,2-dimethyl-N-[2-[(1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl)amino]-2-oxoethyl]-N-[[4-(trifluoromethyl)phenyl]methyl]propanamide |
Molecular weight | 530.548 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 3.5 |
Synonyms | BDBM50301962 (+/-)-N-(2-(3-methyl-2,5-dioxo-1'',3''-dihydrospiro[imidazolidine-4,2''-indene]-5''-ylamino)-2-oxoethyl)-N-(4-(trifluoromethyl)benzyl)pivalamide |
Inchi Key | BAAAFCFMTPDYKI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H29F3N4O4/c1-25(2,3)23(37)34(14-16-5-8-19(9-6-16)27(28,29)30)15-21(35)31-20-10-7-17-12-26(13-18(17)11-20)22(36)32-24(38)33(26)4/h5-11H,12-15H2,1-4H3,(H,31,35)(H,32,36,38) |
PubChem CID | 45485609 |
ChEMBL | CHEMBL577304 |
IUPHAR | N/A |
BindingDB | 50301962 |
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 |
---|---|---|---|---|---|
18657 | Calcitonin gene-related peptide type 1 receptor | Q16602 | CALCRL | Homo sapiens (Human) | 461 |
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