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Ligand

NameCHEMBL431668
Molecular formulaC34H44N4O4
IUPAC name(E)-5-amino-N-[(2R)-1-[[(2R)-1-[[(2R)-2-hydroxypropyl]amino]-1-oxo-3-phenylpropan-2-yl]-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-N,5-dimethylhex-2-enamide
Molecular weight572.75
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP4.0
SynonymsBDBM50066812
(E)-5-Amino-5-methyl-hex-2-enoic acid ((R)-1-{[(R)-1-((R)-2-hydroxy-propylcarbamoyl)-2-phenyl-ethyl]-methyl-carbamoyl}-2-naphthalen-2-yl-ethyl)-methyl-amide
Inchi KeyDWUSBSNQJAVZQW-LBBUWDOLSA-N
Inchi IDInChI=1S/C34H44N4O4/c1-24(39)23-36-32(41)29(21-25-12-7-6-8-13-25)38(5)33(42)30(37(4)31(40)16-11-19-34(2,3)35)22-26-17-18-27-14-9-10-15-28(27)20-26/h6-18,20,24,29-30,39H,19,21-23,35H2,1-5H3,(H,36,41)/b16-11+/t24-,29-,30-/m1/s1
PubChem CID10745674
ChEMBLCHEMBL431668
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
70953Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366
70954Growth hormone secretagogue receptor type 1O08725GhsrRattus norvegicus (Rat)364

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