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Ligand

NameCHEMBL1224260
Molecular formulaC22H22FNO
IUPAC name(1R)-N-[[3-(2-fluorophenyl)phenyl]methyl]-1-(3-methoxyphenyl)ethanamine
Molecular weight335.422
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.9
SynonymsSCHEMBL3928389
BDBM50325729
(R)-N-((2''-fluorobiphenyl-3-yl)methyl)-1-(3-methoxyphenyl)ethanamine
Inchi KeyAKNXCVXQUJVRHZ-MRXNPFEDSA-N
Inchi IDInChI=1S/C22H22FNO/c1-16(18-8-6-10-20(14-18)25-2)24-15-17-7-5-9-19(13-17)21-11-3-4-12-22(21)23/h3-14,16,24H,15H2,1-2H3/t16-/m1/s1
PubChem CID49866000
ChEMBLCHEMBL1224260
IUPHARN/A
BindingDB50325729
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
7727Extracellular calcium-sensing receptorP41180CASRHomo sapiens (Human)1078

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