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Ligand

NameCHEMBL165572
Molecular formulaC23H20F6N4O2S
IUPAC name1,1,1-trifluoro-N-[2-[4-[[[2-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-4-yl]amino]methyl]phenyl]phenyl]methanesulfonamide
Molecular weight530.489
Hydrogen bond acceptor12
Hydrogen bond donor2
XlogP6.0
SynonymsC,C,C-Trifluoro-N-{4''-[(2-trifluoromethyl-5,6,7,8-tetrahydro-quinazolin-4-ylamino)-methyl]-biphenyl-2-yl}-methanesulfonamide
BDBM50281630
Inchi KeyFENHKXVPGQPENW-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H20F6N4O2S/c24-22(25,26)21-31-18-7-3-2-6-17(18)20(32-21)30-13-14-9-11-15(12-10-14)16-5-1-4-8-19(16)33-36(34,35)23(27,28)29/h1,4-5,8-12,33H,2-3,6-7,13H2,(H,30,31,32)
PubChem CID44377942
ChEMBLCHEMBL165572
IUPHARN/A
BindingDB50281630
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.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
76427Type-2 angiotensin II receptorP50052AGTR2Homo sapiens (Human)363

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