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Ligand

NameAC1PO0TL
Molecular formulaC19H20N6O3S
IUPAC name6-amino-5-[2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1-cyclopropylpyrimidine-2,4-dione
Molecular weight412.468
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP1.8
SynonymsMLS002169893
CHEMBL1896283
MolPort-005-811-094
HMS3073P09
ZINC8133139
[ Show all ]
Inchi KeyAIILHPVZCJGNRP-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20N6O3S/c1-24-14(9-11-5-3-2-4-6-11)22-23-19(24)29-10-13(26)15-16(20)25(12-7-8-12)18(28)21-17(15)27/h2-6,12H,7-10,20H2,1H3,(H,21,27,28)
PubChem CID9268085
ChEMBLCHEMBL1896283
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
463626Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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