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Ligand

NameMLS000047044
Molecular formulaC21H25N3O5S
IUPAC namebenzyl 2-[2-(4-sulfamoylphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate
Molecular weight431.507
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.0
Synonymsbenzyl 2-[2-(4-sulfamoylphenyl)ethylcarbamoyl]pyrrolidine-1-carboxylate
Opera_ID_236
HMS2301C07
AKOS002108733
MLS001389172
[ Show all ]
Inchi KeyAHNZBTGLZGBUOU-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25N3O5S/c22-30(27,28)18-10-8-16(9-11-18)12-13-23-20(25)19-7-4-14-24(19)21(26)29-15-17-5-2-1-3-6-17/h1-3,5-6,8-11,19H,4,7,12-15H2,(H,23,25)(H2,22,27,28)
PubChem CID3236252
ChEMBLCHEMBL1382384
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5723Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
5722Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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