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Ligand

NameCHEMBL121803
Molecular formulaC29H40N4O4
IUPAC name(E)-5-amino-N,5-dimethyl-N-[(2R)-1-[methyl-[(2R)-1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylmethoxypropan-2-yl]hex-2-enamide
Molecular weight508.663
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.4
SynonymsSCHEMBL6317105
BDBM50066811
N-(5-Amino-5-methyl-2-hexenoyl)-N-methyl-O-Bzl-D-Ser-N-methyl-D-Phe-NHMe
SCHEMBL6317099
(E)-5-Amino-5-methyl-hex-2-enoic acid {(R)-2-benzyloxy-1-[methyl-((R)-1-methylcarbamoyl-2-phenyl-ethyl)-carbamoyl]-ethyl}-methyl-amide
Inchi KeyXWYYKUODLCJVGU-CHPXNICDSA-N
Inchi IDInChI=1S/C29H40N4O4/c1-29(2,30)18-12-17-26(34)32(4)25(21-37-20-23-15-10-7-11-16-23)28(36)33(5)24(27(35)31-3)19-22-13-8-6-9-14-22/h6-17,24-25H,18-21,30H2,1-5H3,(H,31,35)/b17-12+/t24-,25-/m1/s1
PubChem CID10649323
ChEMBLCHEMBL121803
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
402944Growth hormone secretagogue receptor type 1O08725GhsrRattus norvegicus (Rat)364
402945Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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