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Ligand

NameAC1NP1QC
Molecular formulaC26H29N5O4S
IUPAC name2-[[5,7-dimethyl-6-[(4-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide
Molecular weight507.609
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.8
SynonymsCHEMBL1396646
MCULE-7904567835
2-[[5,7-dimethyl-6-[(4-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide
AKOS002112014
ZINC3045727
[ Show all ]
Inchi KeyAGAJMXNDFIGHEI-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H29N5O4S/c1-15-7-9-18(10-8-15)11-20-16(2)27-25-29-26(30-31(25)17(20)3)36-14-23(32)28-19-12-21(33-4)24(35-6)22(13-19)34-5/h7-10,12-13H,11,14H2,1-6H3,(H,28,32)
PubChem CID5098059
ChEMBLCHEMBL1396646
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463454Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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