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Ligand

NameCHEMBL106807
Molecular formulaC24H31ClN4O2
IUPAC name2-[4-chloro-3-(4-methylpiperazin-1-yl)phenoxy]-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone
Molecular weight442.988
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.9
Synonyms2-[4-Chloro-3-(4-methyl-piperazin-1-yl)-phenoxy]-1-(4-o-tolyl-piperazin-1-yl)-ethanone; compound with (E)-but-2-enedioic acid
CHEMBL1179968
BDBM50290923
Inchi KeyBBJVEASJHDPHCO-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H31ClN4O2/c1-19-5-3-4-6-22(19)27-13-15-29(16-14-27)24(30)18-31-20-7-8-21(25)23(17-20)28-11-9-26(2)10-12-28/h3-8,17H,9-16,18H2,1-2H3
PubChem CID44337731
ChEMBLN/A
IUPHARN/A
BindingDB50290923
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
195535-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
195525-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
195515-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377

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