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Ligand

NameBRN 5360513
Molecular formulaC24H32N2O2S2
IUPAC name1-[5-[[4-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanylmethyl]phenyl]methylsulfanylmethyl]furan-2-yl]-N,N-dimethylmethanamine
Molecular weight444.652
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.8
Synonyms2-Furanmethanamine, 5,5'-(1,4-phenylenebis(methylenethiomethylene))bis(N,N-dimethyl-
DTXSID60160831
AC1MIKNM
138878-53-2
5,5'-(1,4-Phenylenebis(methylenethiomethylene))bis(N,N-dimethyl-2-furanmethanamine)
[ Show all ]
Inchi KeyBKKRKDDJCRFGHJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H32N2O2S2/c1-25(2)13-21-9-11-23(27-21)17-29-15-19-5-7-20(8-6-19)16-30-18-24-12-10-22(28-24)14-26(3)4/h5-12H,13-18H2,1-4H3
PubChem CID3071779
ChEMBLCHEMBL12472
IUPHARN/A
BindingDB50005502
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
25866Muscarinic acetylcholine receptor M1P12657Chrm1Mus musculus (Mouse)460
25867Muscarinic acetylcholine receptor M2Q9ERZ4Chrm2Mus musculus (Mouse)466

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