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Ligand

NameCHEMBL577304
Molecular formulaC27H29F3N4O4
IUPAC name2,2-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 weight530.548
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.5
SynonymsBDBM50301962
(+/-)-N-(2-(3-methyl-2,5-dioxo-1'',3''-dihydrospiro[imidazolidine-4,2''-indene]-5''-ylamino)-2-oxoethyl)-N-(4-(trifluoromethyl)benzyl)pivalamide
Inchi KeyBAAAFCFMTPDYKI-UHFFFAOYSA-N
Inchi IDInChI=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 CID45485609
ChEMBLCHEMBL577304
IUPHARN/A
BindingDB50301962
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
18657Calcitonin gene-related peptide type 1 receptorQ16602CALCRLHomo sapiens (Human)461

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