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Ligand

NameCHEMBL103854
Molecular formulaC14H20N4O2S
IUPAC name2-[5-[(5-methyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)methyl]-1H-indol-3-yl]ethanamine
Molecular weight308.4
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP0.1
SynonymsBDBM50422017
SCHEMBL8806448
Inchi KeyFLHNKTVKQJBVRT-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H20N4O2S/c1-17-6-7-18(21(17,19)20)10-11-2-3-14-13(8-11)12(4-5-15)9-16-14/h2-3,8-9,16H,4-7,10,15H2,1H3
PubChem CID11722814
ChEMBLCHEMBL103854
IUPHARN/A
BindingDB50422017
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
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GLASS IDNameUniProtGeneSpeciesLength
812395-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
812405-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
812385-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357

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