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Ligand

NameCHEMBL337124
Molecular formulaC23H27FN2O6
IUPAC name(Z)-but-2-enedioic acid;2-(4-fluorophenyl)-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]ethanone;hydrate
Molecular weight446.475
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyHDLHUSDCHOGWOI-FJOGWHKWSA-N
Inchi IDInChI=1S/C19H21FN2O.C4H4O4.H2O/c20-18-3-1-15(2-4-18)13-19(23)17-7-11-22(12-8-17)14-16-5-9-21-10-6-16;5-3(6)1-2-4(7)8;/h1-6,9-10,17H,7-8,11-14H2;1-2H,(H,5,6)(H,7,8);1H2/b;2-1-;
PubChem CID44357701
ChEMBLCHEMBL337124
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
112065D(2) dopamine receptorP61168Drd2Mus musculus (Mouse)444

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