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Ligand

NameCHEMBL333028
Molecular formulaC20H23ClFN3O3
IUPAC name2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate
Molecular weight407.87
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.4
Synonyms2-Methoxy-4-amino-5-chlorobenzoic acid 2-[4-(4-fluorophenyl)piperazino]ethyl ester
BDBM50092556
4-Amino-5-chloro-2-methoxy-benzoic acid 2-[4-(4-fluoro-phenyl)-piperazin-1-yl]-ethyl ester
Inchi KeyAHSZYFPXZMOGPF-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H23ClFN3O3/c1-27-19-13-18(23)17(21)12-16(19)20(26)28-11-10-24-6-8-25(9-7-24)15-4-2-14(22)3-5-15/h2-5,12-13H,6-11,23H2,1H3
PubChem CID10669143
ChEMBLCHEMBL333028
IUPHARN/A
BindingDB50092556
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
58625-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388

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