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Ligand

NameCHEMBL373167
Molecular formulaC24H24N2O4S
IUPAC nameN-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(4-methoxyphenyl)benzenesulfonamide
Molecular weight436.526
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.7
SynonymsHMS1797L21
Oprea1_352574
AKOS000595075
MLS000713602
SR-01000464219
[ Show all ]
Inchi KeyBZGWOAPYSQGIIV-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24N2O4S/c1-30-22-13-11-21(12-14-22)26(31(28,29)23-9-3-2-4-10-23)18-24(27)25-16-15-19-7-5-6-8-20(19)17-25/h2-14H,15-18H2,1H3
PubChem CID1135733
ChEMBLCHEMBL373167
IUPHARN/A
BindingDB50178176
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
36437Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
36438Oxytocin receptorP30559OXTRHomo sapiens (Human)389
36439Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418

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