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Ligand

NameMLS000686201
Molecular formulaC17H18N6O2S
IUPAC nameN-(oxolan-2-ylmethyl)-2-[(6-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]acetamide
Molecular weight370.431
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP1.0
SynonymsCHEMBL1544280
MCULE-4350073561
AKOS024654256
SMR000324239
F2507-0290
[ Show all ]
Inchi KeyAAQYLQAZDRXQKV-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H18N6O2S/c24-16(19-10-12-4-3-9-25-12)11-26-17-21-20-15-7-6-14(22-23(15)17)13-5-1-2-8-18-13/h1-2,5-8,12H,3-4,9-11H2,(H,19,24)
PubChem CID16194809
ChEMBLCHEMBL1544280
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
450Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
451Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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