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Ligand

NameCHEMBL424101
Molecular formulaC19H20ClN3O5S2
IUPAC name3-[(4-chloro-5-methyl-1,2-oxazol-3-yl)sulfamoyl]-N-[3-(hydroxymethyl)-2,4,6-trimethylphenyl]thiophene-2-carboxamide
Molecular weight469.955
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP3.3
SynonymsSCHEMBL6592605
Inchi KeyAZCKBKXINSCRTE-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20ClN3O5S2/c1-9-7-10(2)16(11(3)13(9)8-24)21-19(25)17-14(5-6-29-17)30(26,27)23-18-15(20)12(4)28-22-18/h5-7,24H,8H2,1-4H3,(H,21,25)(H,22,23)
PubChem CID10672043
ChEMBLCHEMBL424101
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
18021Endothelin-1 receptorP25101EDNRAHomo sapiens (Human)427

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