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Ligand

NameSMR000005863
Molecular formulaC20H19N7OS2
IUPAC nameN-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-[(4-propyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Molecular weight437.54
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP3.1
SynonymsCHEBI:114416
N-(5-Phenyl-[1,3,4]thiadiazol-2-yl)-2-(4-propyl-5-pyridin-2-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide
HMS2349J05
SR-01000341686-1
AKOS000798556
[ Show all ]
Inchi KeyAEINRCKWDKCKJY-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19N7OS2/c1-2-12-27-17(15-10-6-7-11-21-15)23-26-20(27)29-13-16(28)22-19-25-24-18(30-19)14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,22,25,28)
PubChem CID651558
ChEMBLCHEMBL1380550
IUPHARN/A
BindingDBN/A
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
463314Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
3496Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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