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Ligand

NameCHEMBL95302
Molecular formulaC19H23N5O4
IUPAC name(5S)-2-(hydroxymethyl)-5-[6-(2-propan-2-ylanilino)purin-9-yl]oxolane-3,4-diol
Molecular weight385.424
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP2.3
SynonymsN/A
Inchi KeyAEIAQTQSFDKUPO-SRMCDNDASA-N
Inchi IDInChI=1S/C19H23N5O4/c1-10(2)11-5-3-4-6-12(11)23-17-14-18(21-8-20-17)24(9-22-14)19-16(27)15(26)13(7-25)28-19/h3-6,8-10,13,15-16,19,25-27H,7H2,1-2H3,(H,20,21,23)/t13?,15?,16?,19-/m0/s1
PubChem CID44328202
ChEMBLCHEMBL95302
IUPHARN/A
BindingDB50090694
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
547941Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
547939Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
547942Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398
547940Nociceptin receptorP41146OPRL1Homo sapiens (Human)370

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