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Ligand

NameCHEMBL282666
Molecular formulaC28H19FN4O3
IUPAC name2-[3-[6-(2-fluorophenyl)-1-methyl-4,6-dihydro-[1,2,4]triazolo[4,3-a][4,1]benzoxazepin-8-yl]prop-2-ynyl]isoindole-1,3-dione
Molecular weight478.483
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.4
Synonyms2-{3-[6-(2-Fluoro-phenyl)-1-methyl-4H,6H-5-oxa-2,3,10b-triaza-benzo[e]azulen-8-yl]-prop-2-ynyl}-isoindole-1,3-dione
BDBM50011647
Inchi KeyDBDRVZPLYRUKRB-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H19FN4O3/c1-17-30-31-25-16-36-26(21-10-4-5-11-23(21)29)22-15-18(12-13-24(22)33(17)25)7-6-14-32-27(34)19-8-2-3-9-20(19)28(32)35/h2-5,8-13,15,26H,14,16H2,1H3
PubChem CID14894759
ChEMBLCHEMBL282666
IUPHARN/A
BindingDB50011647
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
55559Platelet-activating factor receptorP25105PTAFRHomo sapiens (Human)342

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