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Ligand

NameCHEMBL319279
Molecular formulaC28H27NO5
IUPAC name(1S,2S,3S)-2-[1-amino-1-carboxy-2-(9H-xanthen-9-yl)ethyl]-3-(2-phenylethyl)cyclopropane-1-carboxylic acid
Molecular weight457.526
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.1
SynonymsBDBM50072176
(1S,2S,3S)-2-[1-Amino-1-carboxy-2-(9H-xanthen-9-yl)-ethyl]-3-phenethyl-cyclopropanecarboxylic acid
Inchi KeyBCMKQOREHHIJIN-KOUVAXTNSA-N
Inchi IDInChI=1S/C28H27NO5/c29-28(27(32)33,25-20(24(25)26(30)31)15-14-17-8-2-1-3-9-17)16-21-18-10-4-6-12-22(18)34-23-13-7-5-11-19(21)23/h1-13,20-21,24-25H,14-16,29H2,(H,30,31)(H,32,33)/t20-,24+,25+,28?/m1/s1
PubChem CID10456810
ChEMBLCHEMBL319279
IUPHARN/A
BindingDB50072176
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
20309Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
20314Metabotropic glutamate receptor 2P31421Grm2Rattus norvegicus (Rat)872
20313Metabotropic glutamate receptor 3P31422Grm3Rattus norvegicus (Rat)879
20310Metabotropic glutamate receptor 4Q14833GRM4Homo sapiens (Human)912
20312Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212
20315Metabotropic glutamate receptor 7Q14831GRM7Homo sapiens (Human)915
20311Metabotropic glutamate receptor 8O00222GRM8Homo sapiens (Human)908

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