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Ligand

NameCHEMBL93594
Molecular formulaC15H23NO3S
IUPAC name[3-[(3S)-1-propylpiperidin-3-yl]phenyl] methanesulfonate
Molecular weight297.413
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.9
SynonymsSCHEMBL7352788
BDBM50039747
Methanesulfonic acid 3-((S)-1-propyl-piperidin-3-yl)-phenyl ester
ZINC13738259
Methanesulfonic acid 3-[(3S)-1-propylpiperidin-3alpha-yl]phenyl ester
Inchi KeyAHSLTJCTFBJCMT-CQSZACIVSA-N
Inchi IDInChI=1S/C15H23NO3S/c1-3-9-16-10-5-7-14(12-16)13-6-4-8-15(11-13)19-20(2,17)18/h4,6,8,11,14H,3,5,7,9-10,12H2,1-2H3/t14-/m1/s1
PubChem CID10402381
ChEMBLCHEMBL93594
IUPHARN/A
BindingDB50039747
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
58505-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
5848D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
5849D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
5847D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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