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Ligand

NameRWJ-25730
Molecular formulaC25H36N4O2
IUPAC name1-[[1-methyl-5-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]pyrrol-2-yl]methyl]piperidin-2-one
Molecular weight424.589
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.7
Synonyms1-{5-[4-(2-Isopropoxy-phenyl)-piperazin-1-ylmethyl]-1-methyl-1H-pyrrol-2-ylmethyl}-piperidin-2-one
SCHEMBL9751073
BLFPEKXTSDYQOQ-UHFFFAOYSA-N
1-[[1-methyl-5-[[4-[2-(1-methylethoxy)phenyl]-1 -piperazinyl]methyl]-lH-pyrrol-2-yl]methyl]-2- piperidinone
D0R9PL
[ Show all ]
Inchi KeyBLFPEKXTSDYQOQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H36N4O2/c1-20(2)31-24-9-5-4-8-23(24)28-16-14-27(15-17-28)18-21-11-12-22(26(21)3)19-29-13-7-6-10-25(29)30/h4-5,8-9,11-12,20H,6-7,10,13-19H2,1-3H3
PubChem CID9910257
ChEMBLCHEMBL428175
IUPHARN/A
BindingDB50001869
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
265055-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
265045-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
26506D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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