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Ligand

NameCHEMBL518157
Molecular formulaC20H26N2O5S2
IUPAC namebutyl N-[3-(4-carbamoylphenyl)-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate
Molecular weight438.557
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.5
SynonymsBDBM50251464
butyl 3-(4-carbamoylphenyl)-5-isobutylthiophen-2-ylsulfonylcarbamate
Inchi KeyOYEOYUQRRQBSEJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H26N2O5S2/c1-4-5-10-27-20(24)22-29(25,26)19-17(12-16(28-19)11-13(2)3)14-6-8-15(9-7-14)18(21)23/h6-9,12-13H,4-5,10-11H2,1-3H3,(H2,21,23)(H,22,24)
PubChem CID44567709
ChEMBLCHEMBL518157
IUPHARN/A
BindingDB50251464
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
253153Type-1 angiotensin II receptorP30555AGTR1Sus scrofa (Pig)359
253154Type-1A angiotensin II receptorP25095Agtr1Rattus norvegicus (Rat)359

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