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Ligand

NameCHEMBL454089
Molecular formulaC21H22N6O3S
IUPAC name5-[4-[2-[(2-sulfanylidene-1,3-dihydrobenzimidazol-4-yl)oxy]ethyl]piperazin-1-yl]-1,4-dihydroquinoxaline-2,3-dione
Molecular weight438.506
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP1.3
SynonymsN/A
Inchi KeyBBVRNVXIUCZFBW-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H22N6O3S/c28-19-20(29)24-17-13(22-19)3-1-5-15(17)27-9-7-26(8-10-27)11-12-30-16-6-2-4-14-18(16)25-21(31)23-14/h1-6H,7-12H2,(H,22,28)(H,24,29)(H2,23,25,31)
PubChem CID44561222
ChEMBLCHEMBL454089
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
19880Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328

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