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Ligand

NameMLS000096632
Molecular formulaC16H18N2O5S
IUPAC nameethyl 2-[4-(pyridin-4-ylmethylsulfamoyl)phenoxy]acetate
Molecular weight350.389
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP1.6
Synonymsethyl (4-{[(4-pyridinylmethyl)amino]sulfonyl}phenoxy)acetate
SMR000073796
ethyl 2-[4-(pyridin-4-ylmethylsulfamoyl)phenoxy]acetate
{4-[(Pyridin-4-ylmethyl)-sulfamoyl]-phenoxy}-acetic acid ethyl ester
ChemDiv2_001984
[ Show all ]
Inchi KeyINMOBAGWVIAPNU-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H18N2O5S/c1-2-22-16(19)12-23-14-3-5-15(6-4-14)24(20,21)18-11-13-7-9-17-10-8-13/h3-10,18H,2,11-12H2,1H3
PubChem CID1082996
ChEMBLCHEMBL1382898
IUPHARN/A
BindingDB42040
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
137408Galanin receptor type 2O43603GALR2Homo sapiens (Human)387
479853Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
137409Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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