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Ligand

NameCHEMBL208551
Molecular formulaC26H27N5O2
IUPAC name6-(4-methoxy-2-methylphenyl)-2-[6-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridin-3-yl]phthalazin-1-one
Molecular weight441.535
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.6
SynonymsBDBM50189577
6-(4-methoxy-2-methylphenyl)-2-(6-((S)-3-(methylamino)pyrrolidin-1-yl)pyridin-3-yl)phthalazin-1(2H)-one
Inchi KeyHCVLQMDNMILQJN-FQEVSTJZSA-N
Inchi IDInChI=1S/C26H27N5O2/c1-17-12-22(33-3)6-8-23(17)18-4-7-24-19(13-18)14-29-31(26(24)32)21-5-9-25(28-15-21)30-11-10-20(16-30)27-2/h4-9,12-15,20,27H,10-11,16H2,1-3H3/t20-/m0/s1
PubChem CID11546697
ChEMBLCHEMBL208551
IUPHARN/A
BindingDBN/A
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
111650Melanin-concentrating hormone receptor 1P97639Mchr1Rattus norvegicus (Rat)353

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