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Ligand

NameCHEMBL302396
Molecular formulaC23H27N3O3S
IUPAC nameN-propyl-N-(1-thiophen-2-ylcyclopropyl)-4-(2,4,6-trimethoxyphenyl)pyrimidin-2-amine
Molecular weight425.547
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.7
SynonymsBDBM50144190
Propyl-(1-thiophen-2-yl-cyclopropyl)-[4-(2,4,6-trimethoxy-phenyl)-pyrimidin-2-yl]-amine
Inchi KeyBBVBVFFELLROLS-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H27N3O3S/c1-5-12-26(23(9-10-23)20-7-6-13-30-20)22-24-11-8-17(25-22)21-18(28-3)14-16(27-2)15-19(21)29-4/h6-8,11,13-15H,5,9-10,12H2,1-4H3
PubChem CID44305986
ChEMBLCHEMBL302396
IUPHARN/A
BindingDB50144190
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
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GLASS IDNameUniProtGeneSpeciesLength
19865Corticotropin-releasing factor receptor 1P34998CRHR1Homo sapiens (Human)444

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