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Gene Set: D4 : TTD - MRE-0094


Collection D4 : TTD
Chemical Name MRE-0094 ( From PubChem : 131865-88-8 )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
421.835 g/mol 4 10 0.8761 True
Structure
InChI InChI=1S/C18H20ClN5O5/c19-10-3-1-9(2-4-10)5-6-28-18-22-15(20)12-16(23-18)24(8-21-12)17-14(27)13(26)11(7-25)29-17/h1-4,8,11,13-14,17,25-27H,5-7H2,(H2,20,22,23)/t11-,13-,14+,17+/m0/s1
InChIKey WUCQGGOGHZRELS-HVOFVXBASA-N
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Gene (1 / 2)


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Source Type Unit Value Gene PMID Assay Other
TTDAgonistADORA2ASuccessful target
TTDDrug(s)ADORA2ASuccessful target
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