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Gene Set: D1 - Approved - TRIOXSALEN


Collection D1 : Approved
Chemical Name TRIOXSALEN
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
ApprovedNotNotApprovedNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
228.243 g/mol 0 3 3.4644 True
Structure
InChI InChI=1S/C14H12O3/c1-7-4-12(15)17-14-9(3)13-10(6-11(7)14)5-8(2)16-13/h4-6H,1-3H3
InChIKey FMHHVULEAZTJMA-UHFFFAOYSA-N
Links

Gene (5 / 10)


⊖ Less

Source Type Unit Value Gene PMID Assay Other
PubChem IC50uM1.312ADORA2A-GI(Protien) :
PubChem uMCYP1A2-GI(Protien) :
PubChem uMCYP1A2-GI(Protien) :
PubChem PotencyuM3.981CYP3A4-GI(Protien) :
PubChem uMCYP3A4-GI(Protien) :
PubChem IC50uM2.356HTR2C-GI(Protien) :
PubChem IC50uM0.831MAOA-GI(Protien) :
ChEMBLAC50nM1000.000CYP1A2
-Target : CHEMBL3356
ChEMBLPotencynM3981.100CYP3A4
-Target : CHEMBL340
ChEMBLAC50nM3981.070CYP3A4
-Target : CHEMBL340
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