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Ligand

NameCHEMBL309730
Molecular formulaC22H28N2O2
IUPAC name1-[2-[(1S)-3,4-dihydro-1H-isochromen-1-yl]ethyl]-4-(4-methoxyphenyl)piperazine
Molecular weight352.478
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.6
SynonymsBDBM50051561
1-((S)-2-Isochroman-1-yl-ethyl)-4-(4-methoxy-phenyl)-piperazine
1alpha-[2-[4-(4-Methoxyphenyl)-1-piperazinyl]ethyl]-3,4-dihydro-1H-2-benzopyran
Inchi KeyIAUNACXRZSWWJT-QFIPXVFZSA-N
Inchi IDInChI=1S/C22H28N2O2/c1-25-20-8-6-19(7-9-20)24-15-13-23(14-16-24)12-10-22-21-5-3-2-4-18(21)11-17-26-22/h2-9,22H,10-17H2,1H3/t22-/m0/s1
PubChem CID10784211
ChEMBLCHEMBL309730
IUPHARN/A
BindingDB50051561
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1287715-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
128772D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
128768D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
128769D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446
128770D(4) dopamine receptorP30729Drd4Rattus norvegicus (Rat)387

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