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Ligand

NameCHEMBL2011832
Molecular formulaC33H38N4O4
IUPAC name4-[(2R)-3-methyl-1-oxo-1-[4-[[(1R)-1-phenylethyl]amino]piperidin-1-yl]butan-2-yl]-7-phenoxy-1,3-dihydro-1,4-benzodiazepine-2,5-dione
Molecular weight554.691
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.8
SynonymsBDBM50379322
Inchi KeyARZUYFDFMKIKHV-SLGOVJDISA-N
Inchi IDInChI=1S/C33H38N4O4/c1-22(2)31(33(40)36-18-16-25(17-19-36)34-23(3)24-10-6-4-7-11-24)37-21-30(38)35-29-15-14-27(20-28(29)32(37)39)41-26-12-8-5-9-13-26/h4-15,20,22-23,25,31,34H,16-19,21H2,1-3H3,(H,35,38)/t23-,31-/m1/s1
PubChem CID70681021
ChEMBLCHEMBL2011832
IUPHARN/A
BindingDB50379322
DrugBankN/A

Structure

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

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
12948Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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