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Ligand

NameSCHEMBL1704702
Molecular formulaC26H33F3N4O
IUPAC name2-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]-1-[4-[3-(trifluoromethyl)anilino]piperidin-1-yl]ethanone
Molecular weight474.572
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.0
SynonymsCHEMBL2364269
Inchi KeyDNXDIZDCMLZGSW-IBGZPJMESA-N
Inchi IDInChI=1S/C26H33F3N4O/c1-19-17-32(14-11-30-19)18-21-7-5-20(6-8-21)15-25(34)33-12-9-23(10-13-33)31-24-4-2-3-22(16-24)26(27,28)29/h2-8,16,19,23,30-31H,9-15,17-18H2,1H3/t19-/m0/s1
PubChem CID15984999
ChEMBLCHEMBL2364269
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
64731Motilin receptorO43193MLNRHomo sapiens (Human)412

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