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Ligand

NameMLS002170095
Molecular formulaC15H22N2O3
IUPAC nameN-[(2S)-1-(cycloheptylamino)-1-oxopropan-2-yl]furan-2-carboxamide
Molecular weight278.352
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.7
SynonymsCHEMBL1409765
MolPort-004-158-504
HMS3059I11
ZINC8230273
AKOS034792083
[ Show all ]
Inchi KeyACIJRDXFRMHJLM-NSHDSACASA-N
Inchi IDInChI=1S/C15H22N2O3/c1-11(16-15(19)13-9-6-10-20-13)14(18)17-12-7-4-2-3-5-8-12/h6,9-12H,2-5,7-8H2,1H3,(H,16,19)(H,17,18)/t11-/m0/s1
PubChem CID9360813
ChEMBLCHEMBL1409765
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
463146Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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