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Ligand

NameCHEMBL63003
Molecular formulaC30H35N3O3
IUPAC name(2R)-2-amino-1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-3-naphthalen-1-ylpropan-1-one
Molecular weight485.628
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.0
SynonymsBDBM50220463
Inchi KeyBWVYMOZIPOAYMY-MUUNZHRXSA-N
Inchi IDInChI=1S/C30H35N3O3/c31-28(21-25-7-3-6-22-5-1-2-8-27(22)25)30(35)33-18-16-32(17-19-33)15-4-20-36-26-13-11-24(12-14-26)29(34)23-9-10-23/h1-3,5-8,11-14,23,28H,4,9-10,15-21,31H2/t28-/m1/s1
PubChem CID44304294
ChEMBLCHEMBL63003
IUPHARN/A
BindingDB50220463
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34775Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
34773Histamine H2 receptorP25021HRH2Homo sapiens (Human)359
34774Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445

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