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Ligand

NameAC1N17QH
Molecular formulaC16H14FN5O3S3
IUPAC name6-amino-5-[2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione
Molecular weight439.498
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP2.9
SynonymsMLS002157422
CHEMBL1490219
MolPort-004-109-403
HMS3068H19
ZINC9283408
[ Show all ]
Inchi KeyGTOAUYAZMQXOAU-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H14FN5O3S3/c1-20-12(18)11(13(24)21(2)15(20)25)10(23)7-27-14-19-22(16(26)28-14)9-5-3-8(17)4-6-9/h3-6H,7,18H2,1-2H3
PubChem CID4000951
ChEMBLCHEMBL1490219
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
475866Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
105017Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
105018Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
105019Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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