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Ligand

NameMLS000046638
Molecular formulaC21H32N2O3S
IUPAC name(4-benzylpiperidin-1-yl)-(1-propylsulfonylpiperidin-3-yl)methanone
Molecular weight392.558
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.1
SynonymsREGID_for_CID_3237289
[4-(phenylmethyl)piperidin-1-yl]-(1-propylsulfonylpiperidin-3-yl)methanone
(4-benzylpiperidino)-(1-propylsulfonyl-3-piperidyl)methanone
EU-0098038
AC1MME1E
[ Show all ]
Inchi KeyANDSXDKABIYGPB-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H32N2O3S/c1-2-15-27(25,26)23-12-6-9-20(17-23)21(24)22-13-10-19(11-14-22)16-18-7-4-3-5-8-18/h3-5,7-8,19-20H,2,6,9-17H2,1H3
PubChem CID3237289
ChEMBLCHEMBL1430943
IUPHARN/A
BindingDB37695
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9473fMet-Leu-Phe receptorP21462FPR1Homo sapiens (Human)350
9474Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
9472N-formyl peptide receptor 2P25090FPR2Homo sapiens (Human)351

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