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Ligand

Namenaloxone
Molecular formulaC19H21NO4
IUPAC name(4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Molecular weight327.38
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.1
Synonyms(-)-N-allyl-14-hydroxynordihydroxymorphinan-6-one
(-)-Naloxone
(1S,5R,13R,17S)-10,17-dihydroxy-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0;{1,13}.0;{5,17}.0;{7,18}]octadeca-7(18),8,10-trien-14-one
(1S,5R,13R,17S)-10,17-dihydroxy-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-trien-14-one
(4R,4aS,7aR,12bS)-3-allyl-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride
[ Show all ]
Inchi KeyUZHSEJADLWPNLE-GRGSLBFTSA-N
Inchi IDInChI=1S/C19H21NO4/c1-2-8-20-9-7-18-15-11-3-4-12(21)16(15)24-17(18)13(22)5-6-19(18,23)14(20)10-11/h2-4,14,17,21,23H,1,5-10H2/t14-,17+,18+,19-/m1/s1
PubChem CID5284596
ChEMBLCHEMBL80
IUPHAR1638, 1676
BindingDB50000788, 54795
DrugBankDB01183

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 21
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
5569075-hydroxytryptamine receptor 7P32305Htr7Rattus norvegicus (Rat)448
349336Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
455585Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318
349328C-C chemokine receptor type 5P51682Ccr5Mus musculus (Mouse)354
349332D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
556906D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
349333D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446
349321Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
349322Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
349329Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
462227Delta-type opioid receptorP79291OPRD1Sus scrofa (Pig)228
349325Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
349326Kappa-type opioid receptorP33534Oprk1Mus musculus (Mouse)380
349330Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
349331Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
349323Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
349324Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398
349327Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398
349334Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98
349335Mu-type opioid receptorP79350OPRM1Bos taurus (Bovine)401

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