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Ligand

NameCHEMBL346163
Molecular formulaC16H23NO
IUPAC name3-[1-(cyclopropylmethyl)-3-methylpiperidin-3-yl]phenol
Molecular weight245.366
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP3.4
Synonyms3-(1-Cyclopropylmethyl-3-methyl-piperidin-3-yl)-phenol
BDBM50021324
3-(1-Cyclopropylmethyl-3-methyl-piperidin-3-yl)-phenol:hydrochloricacid
Inchi KeyBFJGDYASFRFDRK-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H23NO/c1-16(14-4-2-5-15(18)10-14)8-3-9-17(12-16)11-13-6-7-13/h2,4-5,10,13,18H,3,6-9,11-12H2,1H3
PubChem CID13615888
ChEMBLCHEMBL346163
IUPHARN/A
BindingDB50021324
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
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GLASS IDNameUniProtGeneSpeciesLength
22366Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
22367Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
22365Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398

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