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Ligand

NameMLS000538206
Molecular formulaC28H35IN2O5
IUPAC name2-(8-methyl-1,3-dioxo-2-propan-2-yl-2-aza-8-azoniaspiro[4.5]decan-8-yl)ethyl 2-hydroxy-2,2-diphenylacetate;iodide
Molecular weight606.501
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogPNone
SynonymsSMR000162815
MLS001304944
CHEMBL1580595
HMS2285O19
Inchi KeyADJYTCAKYZJIBO-UHFFFAOYSA-M
Inchi IDInChI=1S/C28H35N2O5.HI/c1-21(2)29-24(31)20-27(25(29)32)14-16-30(3,17-15-27)18-19-35-26(33)28(34,22-10-6-4-7-11-22)23-12-8-5-9-13-23;/h4-13,21,34H,14-20H2,1-3H3;1H/q+1;/p-1
PubChem CID11948755
ChEMBLCHEMBL1580595
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463215Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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