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Ligand

NameOprea1_594647
Molecular formulaC23H28ClNO4S
IUPAC nameethyl 4-[[benzyl-(4-chlorophenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate
Molecular weight449.99
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.9
Synonymsethyl 4-({benzyl[(4-chlorophenyl)sulfonyl]amino}methyl)cyclohexanecarboxylate
SR-01000579850-1
MolPort-007-926-085
SCHEMBL1615052
HMS1912D04
[ Show all ]
Inchi KeyGBMWNGYMHVXNDH-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H28ClNO4S/c1-2-29-23(26)20-10-8-19(9-11-20)17-25(16-18-6-4-3-5-7-18)30(27,28)22-14-12-21(24)13-15-22/h3-7,12-15,19-20H,2,8-11,16-17H2,1H3
PubChem CID16034015
ChEMBLCHEMBL1356858
IUPHARN/A
BindingDB211173
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
520088Taste receptor type 2 member 14Q9NYV8TAS2R14Homo sapiens (Human)317

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