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Ligand

NameCHEMBL3618327
Molecular formulaC24H22ClN3O4
IUPAC name6-(4-chlorophenyl)-3-[4-(2-cyclopropyl-2-hydroxyethoxy)-3-methoxyphenyl]pyrrolo[2,1-f][1,2,4]triazin-4-one
Molecular weight451.907
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50120633
SCHEMBL12257771
Inchi KeyHJNTUQUTZWHBEL-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22ClN3O4/c1-31-23-11-19(8-9-22(23)32-13-21(29)16-2-3-16)27-14-26-28-12-17(10-20(28)24(27)30)15-4-6-18(25)7-5-15/h4-12,14,16,21,29H,2-3,13H2,1H3
PubChem CID45279489
ChEMBLCHEMBL3618327
IUPHARN/A
BindingDB50120633
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
477264Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
477265Melanin-concentrating hormone receptor 1P97639Mchr1Rattus norvegicus (Rat)353

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