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Ligand

NameMLS002157455
Molecular formulaC23H29N5O2S2
IUPAC name4-[4-(benzenesulfonyl)piperazin-1-yl]-5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)thieno[2,3-d]pyrimidine
Molecular weight471.638
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP3.8
SynonymsCHEMBL1727874
MolPort-004-179-619
HMS3054K23
ZINC9789675
AKOS034151601
[ Show all ]
Inchi KeyAALMOIACVXSIMR-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H29N5O2S2/c1-17-18(2)31-23-21(17)22(24-20(25-23)16-26-10-6-7-11-26)27-12-14-28(15-13-27)32(29,30)19-8-4-3-5-9-19/h3-5,8-9H,6-7,10-16H2,1-2H3
PubChem CID16308431
ChEMBLCHEMBL1727874
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
306Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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