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Ligand

NameMLS001006960
Molecular formulaC15H13N3O3S2
IUPAC nameN-[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]thiophene-2-carboxamide
Molecular weight347.407
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.2
SynonymsMolPort-003-249-141
HMS2775J03
Oprea1_306563
AKOS001032463
MLS-0293935.0002
[ Show all ]
Inchi KeyACXMNBTUUKDNKX-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H13N3O3S2/c1-20-9-5-6-10(11(8-9)21-2)14-17-18-15(23-14)16-13(19)12-4-3-7-22-12/h3-8H,1-2H3,(H,16,18,19)
PubChem CID1548617
ChEMBLCHEMBL1340391
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
2020Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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