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Ligand

NameCHEMBL2112580
Molecular formulaC17H20N2O4
IUPAC name(1S,2S)-2-[1-amino-1-carboxy-3-(1-methylindol-3-yl)propyl]cyclopropane-1-carboxylic acid
Molecular weight316.357
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP-1.2
SynonymsBDBM50408691
alpha-Amino-alpha-[2-(1-methyl-1H-indol-3-yl)ethyl]-2beta-carboxycyclopropane-1alpha-acetic acid
Inchi KeyHTCOBNYITGJGFH-RNWUTADCSA-N
Inchi IDInChI=1S/C17H20N2O4/c1-19-9-10(11-4-2-3-5-14(11)19)6-7-17(18,16(22)23)13-8-12(13)15(20)21/h2-5,9,12-13H,6-8,18H2,1H3,(H,20,21)(H,22,23)/t12-,13-,17?/m0/s1
PubChem CID10710505
ChEMBLCHEMBL2112580
IUPHARN/A
BindingDB50408691
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
123323Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872
123322Metabotropic glutamate receptor 3Q14832GRM3Homo sapiens (Human)879

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