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Ligand

NameMLS001094991
Molecular formulaC16H18N2O4S
IUPAC namemethyl 4-(3-phenylpyrrolidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylate
Molecular weight334.39
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP1.9
SynonymsCHEMBL1701522
MolPort-007-823-975
HMS1642E01
HMS2955D03
AKOS001991844
[ Show all ]
Inchi KeyAIJXHMTXEJOMBG-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H18N2O4S/c1-22-16(19)15-9-14(10-17-15)23(20,21)18-8-7-13(11-18)12-5-3-2-4-6-12/h2-6,9-10,13,17H,7-8,11H2,1H3
PubChem CID20938581
ChEMBLCHEMBL1701522
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
463632Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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