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Ligand

NameCHEMBL3596475
Molecular formulaC28H28F3NO3
IUPAC namemethyl 4-[3-[(4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzoate
Molecular weight483.531
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.8
SynonymsBDBM50106387
SCHEMBL13404212
Inchi KeyGRUCCLVNQQRADI-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H28F3NO3/c1-34-26(33)22-9-7-21(8-10-22)23-15-20(16-25(17-23)28(29,30)31)18-35-19-27(11-13-32-14-12-27)24-5-3-2-4-6-24/h2-10,15-17,32H,11-14,18-19H2,1H3
PubChem CID58993503
ChEMBLCHEMBL3596475
IUPHARN/A
BindingDB50106387
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
475708Substance-P receptorQ5DUB1TACR1Meriones unguiculatus (Mongolian jird)407
560523Substance-P receptorP14600Tacr1Rattus norvegicus (Rat)407

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