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Gene Set: D4 : CTD - Nalbuphine


Collection D4 : CTD
Chemical Name Nalbuphine ( From PubChem : NALBUPHINE )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
ApprovedNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
357.443 g/mol 3 5 1.6452 True
Structure
InChI InChI=1S/C21H27NO4/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12/h4-5,12,15-16,19,23-25H,1-3,6-11H2/t15-,16+,19-,20-,21+/m0/s1
InChIKey NETZHAKZCGBWSS-CEDHKZHLSA-N
Links

Gene (6 / 8)


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Source Type Unit Value Gene PMID Assay Other
CTDincreases(expression)PRL
D009266
CTDdecreases(reaction)SLC22A2
D009266
CTDincreases(uptake)SLC22A2
D009266
ChEMBLInhibition-CYP1A2
-Target : CHEMBL3356
ChEMBLInhibition-CYP2D6
-Target : CHEMBL289
ChEMBLInhibition-CYP3A4
-Target : CHEMBL340
ChEMBLInhibition-CYP3A4
-Target : CHEMBL340
ChEMBLActivity-OPRK1
-Target : CHEMBL237
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