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Ligand

NameAC1M8JC3
Molecular formulaC24H26N4O3
IUPAC name[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 4-(3,5-dimethylpyrazol-1-yl)benzoate
Molecular weight418.497
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.7
SynonymsAKOS033372476
Z14760162
HMS3052L17
956949-62-5
MolPort-004-054-730
[ Show all ]
Inchi KeyABACYGISGDWJLD-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H26N4O3/c1-18-16-19(2)28(25-18)22-10-8-20(9-11-22)24(30)31-17-23(29)27-14-12-26(13-15-27)21-6-4-3-5-7-21/h3-11,16H,12-15,17H2,1-2H3
PubChem CID2487889
ChEMBLCHEMBL2142291
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
463027Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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