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Ligand

NameCHEMBL191171
Molecular formulaC24H25N5S2
IUPAC name4-[3-(1-benzothiophen-2-yl)-5-[2-(1H-indol-3-yl)ethylsulfanyl]-1,2,4-triazol-4-yl]butan-1-amine
Molecular weight447.619
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.8
SynonymsBDBM50169463
4-{3-Benzo[b]thiophen-2-yl-5-[2-(1H-indol-3-yl)-ethylsulfanyl]-[1,2,4]triazol-4-yl}-butylamine
Inchi KeyAZJHEXSDTVCQFF-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H25N5S2/c25-12-5-6-13-29-23(22-15-17-7-1-4-10-21(17)31-22)27-28-24(29)30-14-11-18-16-26-20-9-3-2-8-19(18)20/h1-4,7-10,15-16,26H,5-6,11-14,25H2
PubChem CID44397907
ChEMBLCHEMBL191171
IUPHARN/A
BindingDB50169463
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
18212Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
18213Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

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