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Ligand

NameCHEMBL119825
Molecular formulaC28H33N3O6
IUPAC name2-[[(3R,5S)-4-acetyl-1-benzyl-3-(2,2-dimethylpropyl)-2,7-dioxo-5,6-dihydro-3H-1,4-benzodiazonine-5-carbonyl]amino]acetic acid
Molecular weight507.587
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.9
SynonymsN/A
Inchi KeyAVFMREIJBHKRQO-XZOQPEGZSA-N
Inchi IDInChI=1S/C28H33N3O6/c1-18(32)31-22(26(36)29-16-25(34)35)14-24(33)20-12-8-9-13-21(20)30(17-19-10-6-5-7-11-19)27(37)23(31)15-28(2,3)4/h5-13,22-23H,14-17H2,1-4H3,(H,29,36)(H,34,35)/t22-,23+/m0/s1
PubChem CID10601706
ChEMBLCHEMBL119825
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
15248Gastrin/cholecystokinin type B receptorP56481CckbrMus musculus (Mouse)453
15249Gastrin/cholecystokinin type B receptorP30553CckbrRattus norvegicus (Rat)452

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