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Ligand

NameMLS000673602
Molecular formulaC20H20FN5O4S2
IUPAC name1-(2-fluorophenyl)-3-(2-hydroxy-1-methyl-5-morpholin-4-ylsulfonylindol-3-yl)iminothiourea
Molecular weight477.529
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP2.8
SynonymsSMR000314843
(3Z)-1-methyl-5-(morpholin-4-ylsulfonyl)-1H-indole-2,3-dione 3-[N-(2-fluorophenyl)thiosemicarbazone]
AC1OBCX6
CHEMBL1308615
BDBM54336
[ Show all ]
Inchi KeyAHYFIPCUISVDBK-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H20FN5O4S2/c1-25-17-7-6-13(32(28,29)26-8-10-30-11-9-26)12-14(17)18(19(25)27)23-24-20(31)22-16-5-3-2-4-15(16)21/h2-7,12,27H,8-11H2,1H3,(H,22,31)
PubChem CID4196731
ChEMBLCHEMBL1308615
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
557448Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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