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Ligand

NameCHEMBL288244
Molecular formulaC23H22Cl2FN3OS
IUPAC name(3,4-dichlorophenyl)-[4-fluoro-4-[[(6-thiophen-2-ylpyridin-2-yl)methylamino]methyl]piperidin-1-yl]methanone
Molecular weight478.407
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.8
SynonymsN-[[1-(3,4-Dichlorobenzoyl)-4-fluoro-4-piperidinyl]methyl]-6-(2-thienyl)-2-pyridinemethanamine
SCHEMBL5200248
Inchi KeyADGCARVTPQCUGH-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H22Cl2FN3OS/c24-18-7-6-16(13-19(18)25)22(30)29-10-8-23(26,9-11-29)15-27-14-17-3-1-4-20(28-17)21-5-2-12-31-21/h1-7,12-13,27H,8-11,14-15H2
PubChem CID10719425
ChEMBLCHEMBL288244
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
22495-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
22515-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
2250D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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