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Gene Set: D4 : TTD - S6-nitrobenzyl mercaptopurine riboside


Collection D4 : TTD
Chemical Name S6-nitrobenzyl mercaptopurine riboside ( From PubChem : 4-NITROBENZYLTHIOINOSINE )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
419.412 g/mol 3 9 1.1615 True
Structure
InChI InChI=1S/C17H17N5O6S/c23-5-11-13(24)14(25)17(28-11)21-8-20-12-15(21)18-7-19-16(12)29-6-9-1-3-10(4-2-9)22(26)27/h1-4,7-8,11,13-14,17,23-25H,5-6H2/t11-,13-,14-,17-/m1/s1
InChIKey DYCJFJRCWPVDHY-LSCFUAHRSA-N
Links

Gene (3 / 6)


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Source Type Unit Value Gene PMID Assay Other
TTDInhibitorSLC29A1Successful target
PubChem PotencyuM0.021ATAD5-GI(Protien) :
PubChem PotencyuM12.995TDP1-GI(Protien) :
ChEMBLPotencynM20.600ATAD5
-Target : CHEMBL1741209
ChEMBLInhibition-SLC29A1
-Target : CHEMBL1997
ChEMBLInhibition-SLC29A1
-Target : CHEMBL1997
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