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Ligand

NameCHEMBL1644209
Molecular formulaC19H22Cl2N4O3
IUPAC name1-[6-[2-(2,4-dichlorophenyl)ethylamino]-2-methoxypyrimidin-4-yl]piperidine-4-carboxylic acid
Molecular weight425.31
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.5
SynonymsBYAWAXOLOBCSIC-UHFFFAOYSA-N
SCHEMBL4497733
BDBM50417724
1-{6-[2-(2,4-dichloro-phenyl)-ethylamino]-2-methoxy-pyrimidin-4-yl}-piperidine-4-carboxylic acid
Inchi KeyBYAWAXOLOBCSIC-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H22Cl2N4O3/c1-28-19-23-16(22-7-4-12-2-3-14(20)10-15(12)21)11-17(24-19)25-8-5-13(6-9-25)18(26)27/h2-3,10-11,13H,4-9H2,1H3,(H,26,27)(H,22,23,24)
PubChem CID53317886
ChEMBLCHEMBL1644209
IUPHARN/A
BindingDB50417724
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
35615Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359

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