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Ligand

NameCHEMBL97200
Molecular formulaC24H27NO5
IUPAC name(1S,2S,3S)-2-[1-amino-1-carboxy-2-(9H-xanthen-9-yl)ethyl]-3-(2-methylpropyl)cyclopropane-1-carboxylic acid
Molecular weight409.482
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP1.5
SynonymsBDBM50072170
(1S,2S,3S)-2-[1-Amino-1-carboxy-2-(9H-xanthen-9-yl)-ethyl]-3-isobutyl-cyclopropanecarboxylic acid
Inchi KeyRQZMFVKQWUAIHP-CHYAVIAWSA-N
Inchi IDInChI=1S/C24H27NO5/c1-13(2)11-16-20(22(26)27)21(16)24(25,23(28)29)12-17-14-7-3-5-9-18(14)30-19-10-6-4-8-15(17)19/h3-10,13,16-17,20-21H,11-12,25H2,1-2H3,(H,26,27)(H,28,29)/t16-,20+,21+,24?/m1/s1
PubChem CID44329033
ChEMBLCHEMBL97200
IUPHARN/A
BindingDB50072170
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
303019Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
303020Metabotropic glutamate receptor 2P31421Grm2Rattus norvegicus (Rat)872
303021Metabotropic glutamate receptor 3P31422Grm3Rattus norvegicus (Rat)879
303023Metabotropic glutamate receptor 4Q14833GRM4Homo sapiens (Human)912
303017Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212
303022Metabotropic glutamate receptor 7Q14831GRM7Homo sapiens (Human)915
303018Metabotropic glutamate receptor 8O00222GRM8Homo sapiens (Human)908

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