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Ligand

NameOprea1_386690
Molecular formulaC25H32N2O5S
IUPAC nameethyl 4-[[(4-acetamidophenyl)sulfonyl-benzylamino]methyl]cyclohexane-1-carboxylate
Molecular weight472.6
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.4
SynonymsUS9247759, 5-115
MolPort-007-926-084
AKOS002126495
SR-01000579849
CHEMBL3917592
[ Show all ]
Inchi KeyIEYJOURQJADKKJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H32N2O5S/c1-3-32-25(29)22-11-9-21(10-12-22)18-27(17-20-7-5-4-6-8-20)33(30,31)24-15-13-23(14-16-24)26-19(2)28/h4-8,13-16,21-22H,3,9-12,17-18H2,1-2H3,(H,26,28)
PubChem CID20967312
ChEMBLCHEMBL3917592
IUPHARN/A
BindingDB211169
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
520260Taste receptor type 2 member 14Q9NYV8TAS2R14Homo sapiens (Human)317

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