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Ligand

NameCHEMBL364398
Molecular formulaC23H37N3O3S
IUPAC name2-[2,2-dioxo-1-[1-(4-propan-2-ylcyclohexyl)piperidin-4-yl]-4H-2lambda6,1,3-benzothiadiazin-3-yl]ethanol
Molecular weight435.627
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.3
SynonymsSCHEMBL3868218
BDBM50153132
2-{1-[1-(4-Isopropyl-cyclohexyl)-piperidin-4-yl]-2,2-dioxo-1,4-dihydro-2H-2lambda*6*-benzo[1,2,6]thiadiazin-3-yl}-ethanol
Inchi KeyAEXLHDOOHWXDNZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H37N3O3S/c1-18(2)19-7-9-21(10-8-19)24-13-11-22(12-14-24)26-23-6-4-3-5-20(23)17-25(15-16-27)30(26,28)29/h3-6,18-19,21-22,27H,7-17H2,1-2H3
PubChem CID10137876
ChEMBLCHEMBL364398
IUPHARN/A
BindingDB50153132
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3937Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
3940Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
3938Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
3939Nociceptin receptorP41146OPRL1Homo sapiens (Human)370

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