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Ligand

NameCHEMBL1202209
Molecular formulaC21H25FN2
IUPAC name1-(4-fluoro-2-methylphenyl)-4-[[(1S,2S)-2-phenylcyclopropyl]methyl]piperazine
Molecular weight324.443
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.5
SynonymsCHEMBL339674
BDBM50369663
Inchi KeyAJKCXWJAJVDPNV-UYAOXDASSA-N
Inchi IDInChI=1S/C21H25FN2/c1-16-13-19(22)7-8-21(16)24-11-9-23(10-12-24)15-18-14-20(18)17-5-3-2-4-6-17/h2-8,13,18,20H,9-12,14-15H2,1H3/t18-,20-/m1/s1
PubChem CID10615990
ChEMBLN/A
IUPHARN/A
BindingDB50092760, 50369663
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: 3
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GLASS IDNameUniProtGeneSpeciesLength
6982D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
6981D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467
517356Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358

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