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Gene Set: D4 : TTD - GRASSYSTATIN A


Collection D4 : TTD
Chemical Name GRASSYSTATIN A ( From PubChem : GRASSYSTATIN A )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
1174.43 g/mol 8 25 3.0779 False(1/4)
Structure
InChI InChI=1S/C58H95N9O16/c1-30(2)25-38(43(69)29-45(71)64-46(36(12)68)52(74)60-35(11)54(76)66(15)42(27-37-21-18-17-19-22-37)55(77)67-24-20-23-41(67)56(78)81-16)61-51(73)40(28-44(59)70)62-50(72)39(26-31(3)4)63-53(75)48(33(7)8)82-58(80)49(34(9)10)83-57(79)47(32(5)6)65(13)14/h17-19,21-22,30-36,38-43,46-49,68-69H,20,23-29H2,1-16H3,(H2,59,70)(H,60,74)(H,61,73)(H,62,72)(H,63,75)(H,64,71)/t35-,36+,38-,39-,40-,41-,42+,43-,46-,47-,48+,49-/m0/s1
InChIKey JZYWSTGTBRHGTL-BIXXXADNSA-N
Links

Gene (3 / 3)


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Source Type Unit Value Gene PMID Assay Other
TTDInhibitorCELA1Research target
TTDInhibitorCTSDResearch target
TTDInhibitorPLGSuccessful target
Download gene sets gmt, text, Detailed text
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