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Ligand

NameMLS001201721
Molecular formulaC19H16Cl2N2O4S
IUPAC name2-[1-[(2,4-dichlorophenyl)methyl]-2,4-dioxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl]acetic acid
Molecular weight439.307
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.4
SynonymsSMR000544878
CHEMBL1510859
BDBM64096
cid_15166078
MolPort-002-671-627
[ Show all ]
Inchi KeyACQMQUVREUWIBZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H16Cl2N2O4S/c20-11-6-5-10(13(21)7-11)8-23-18-16(12-3-1-2-4-14(12)28-18)17(26)22(19(23)27)9-15(24)25/h5-7H,1-4,8-9H2,(H,24,25)
PubChem CID15166078
ChEMBLCHEMBL1510859
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
1799Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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