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Ligand

NameCHEMBL397112
Molecular formulaC19H12ClF2NO2S
IUPAC name2-[(E)-2-(2-chloro-4-fluorophenyl)ethenyl]-5-(2-fluorophenyl)sulfonylpyridine
Molecular weight391.817
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.8
Synonyms(E)-2-(2-chloro-4-fluorostyryl)-5-(2-fluorophenylsulfonyl)pyridine
BDBM50205801
Inchi KeyAGNKOCOPBGDROC-SOFGYWHQSA-N
Inchi IDInChI=1S/C19H12ClF2NO2S/c20-17-11-14(21)7-5-13(17)6-8-15-9-10-16(12-23-15)26(24,25)19-4-2-1-3-18(19)22/h1-12H/b8-6+
PubChem CID44439379
ChEMBLCHEMBL397112
IUPHARN/A
BindingDB50205801
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
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GLASS IDNameUniProtGeneSpeciesLength
50475-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
50465-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
5045D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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