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Ligand

NameCHEMBL103388
Molecular formulaC24H31N5O3S
IUPAC nameN-[4-[[5-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]-1,1-dioxo-1,2,5-thiadiazolidin-2-yl]methyl]phenyl]acetamide
Molecular weight469.604
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.8
SynonymsBDBM50422029
SCHEMBL8807080
2-[[3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl]methyl]-5-[4-(acetylamino)benzyl]-1,2,5-thiadiazolidine 1,1-dioxide
Inchi KeyHLROMXIAWNSEJU-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H31N5O3S/c1-18(30)26-22-7-4-19(5-8-22)16-28-12-13-29(33(28,31)32)17-20-6-9-24-23(14-20)21(15-25-24)10-11-27(2)3/h4-9,14-15,25H,10-13,16-17H2,1-3H3,(H,26,30)
PubChem CID10412397
ChEMBLCHEMBL103388
IUPHARN/A
BindingDB50422029
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
1181695-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
1181685-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1181705-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357

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