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Ligand

NameCHEMBL3358004
Molecular formulaC21H23F4N7O3S
IUPAC name[3-fluoro-4-[[2-[(2R)-2-methyl-4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperazin-1-yl]pyrimidin-5-yl]oxymethyl]phenyl]methyl-imino-methyl-oxo-lambda6-sulfane
Molecular weight529.515
Hydrogen bond acceptor14
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50103553
Inchi KeyCDEAEZQLBRDDDP-OYDRJWEHSA-N
Inchi IDInChI=1S/C21H23F4N7O3S/c1-13-10-31(20-30-29-18(35-20)21(23,24)25)5-6-32(13)19-27-8-16(9-28-19)34-11-15-4-3-14(7-17(15)22)12-36(2,26)33/h3-4,7-9,13,26H,5-6,10-12H2,1-2H3/t13-,36?/m1/s1
PubChem CID118722580
ChEMBLCHEMBL3358004
IUPHARN/A
BindingDB50103553
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
443235Glucose-dependent insulinotropic receptorQ7TQP3Gpr119Mus musculus (Mouse)335
443236Glucose-dependent insulinotropic receptorQ8TDV5GPR119Homo sapiens (Human)335

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