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Ligand

NameCHEMBL3618336
Molecular formulaC23H22ClN3O4
IUPAC name6-(4-chlorophenyl)-3-[4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one
Molecular weight439.896
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.1
SynonymsBDBM50120629
SCHEMBL12257753
Inchi KeyGDEZUWDWHVVOHV-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H22ClN3O4/c1-23(2,29)13-31-20-9-8-18(11-21(20)30-3)26-14-25-27-12-16(10-19(27)22(26)28)15-4-6-17(24)7-5-15/h4-12,14,29H,13H2,1-3H3
PubChem CID45279402
ChEMBLCHEMBL3618336
IUPHARN/A
BindingDB50120629
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
474445Melanin-concentrating hormone receptor 1P97639Mchr1Rattus norvegicus (Rat)353
474446Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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