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Ligand

NameCHEMBL453865
Molecular formulaC26H28N6O5
IUPAC nameN,N-dimethyl-3-[3-[2-[[(2R)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]amino]-2-oxoethyl]-2-oxobenzimidazol-1-yl]propanamide
Molecular weight504.547
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP0.3
SynonymsBDBM50246367
(R)-N,N-dimethyl-3-(3-(2-(3-methyl-2,5-dioxo-1'',3''-dihydrospiro[imidazolidine-4,2''-indene]-5''-ylamino)-2-oxoethyl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propanamide
Inchi KeyBFTBSLQNTXGFQQ-AREMUKBSSA-N
Inchi IDInChI=1S/C26H28N6O5/c1-29(2)22(34)10-11-31-19-6-4-5-7-20(19)32(25(31)37)15-21(33)27-18-9-8-16-13-26(14-17(16)12-18)23(35)28-24(36)30(26)3/h4-9,12H,10-11,13-15H2,1-3H3,(H,27,33)(H,28,35,36)/t26-/m1/s1
PubChem CID44563125
ChEMBLCHEMBL453865
IUPHARN/A
BindingDB50246367
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
22614Calcitonin gene-related peptide type 1 receptorQ16602CALCRLHomo sapiens (Human)461

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