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Ligand

NameCHEMBL3561870
Molecular formulaC25H26N2O4S
IUPAC namemethyl 4-[3-[2-[4-[acetyl(methyl)amino]phenyl]sulfanylacetyl]-2,5-dimethylpyrrol-1-yl]benzoate
Molecular weight450.553
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.3
SynonymsVU0452107-1
Inchi KeyNADNOPSVGHDFRP-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H26N2O4S/c1-16-14-23(17(2)27(16)21-8-6-19(7-9-21)25(30)31-5)24(29)15-32-22-12-10-20(11-13-22)26(4)18(3)28/h6-14H,15H2,1-5H3
PubChem CID73058504
ChEMBLCHEMBL3561870
IUPHARN/A
BindingDBN/A
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
541732Metabotropic glutamate receptor 4Q14833GRM4Homo sapiens (Human)912
490016Metabotropic glutamate receptor 7Q14831GRM7Homo sapiens (Human)915
490017Metabotropic glutamate receptor 8O00222GRM8Homo sapiens (Human)908

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