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Ligand

NameCHEMBL1317251
Molecular formulaC21H20N4O5S2
IUPAC nameN-[2-[2-(4-methoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Molecular weight472.534
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP3.2
SynonymsHMS1903I10
CCG-92650
N-(2-(2-(4-methoxyphenyl)thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-sulfonamide
F2521-0294
ZINC8601434
[ Show all ]
Inchi KeyAACSWPKJBKRNAM-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H20N4O5S2/c1-28-16-4-2-14(3-5-16)20-23-21-25(24-20)15(13-31-21)8-9-22-32(26,27)17-6-7-18-19(12-17)30-11-10-29-18/h2-7,12-13,22H,8-11H2,1H3
PubChem CID16032178
ChEMBLCHEMBL1317251
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
462980Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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