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Ligand

NameCHEMBL3596447
Molecular formulaC21H25N5O2
IUPAC name(2S,3S)-3-[[2-methoxy-5-(5-methyltetrazol-1-yl)phenyl]methoxy]-2-phenylpiperidine
Molecular weight379.464
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.9
SynonymsN/A
Inchi KeyDYWKKTAJJCSHMC-SFTDATJTSA-N
Inchi IDInChI=1S/C21H25N5O2/c1-15-23-24-25-26(15)18-10-11-19(27-2)17(13-18)14-28-20-9-6-12-22-21(20)16-7-4-3-5-8-16/h3-5,7-8,10-11,13,20-22H,6,9,12,14H2,1-2H3/t20-,21-/m0/s1
PubChem CID122182822
ChEMBLCHEMBL3596447
IUPHARN/A
BindingDB50108638
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
471856Substance-P receptorQ5DUB1TACR1Meriones unguiculatus (Mongolian jird)407
559544Substance-P receptorP14600Tacr1Rattus norvegicus (Rat)407

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