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Ligand

NameCHEMBL318571
Molecular formulaC18H28N4O2S
IUPAC name2-[5-[(1,1-dioxo-5-propan-2-yl-1,2,5-thiadiazolidin-2-yl)methyl]-1H-indol-3-yl]-N,N-dimethylethanamine
Molecular weight364.508
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP1.9
SynonymsSCHEMBL8807319
BDBM50422023
2-[[3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl]methyl]-5-isopropyl-1,2,5-thiadiazolidine 1,1-dioxide
Inchi KeyHEFIDNYHXDTDFP-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H28N4O2S/c1-14(2)22-10-9-21(25(22,23)24)13-15-5-6-18-17(11-15)16(12-19-18)7-8-20(3)4/h5-6,11-12,14,19H,7-10,13H2,1-4H3
PubChem CID9998879
ChEMBLCHEMBL318571
IUPHARN/A
BindingDB50422023
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
1126735-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
1126755-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1126745-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357

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