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Gene Set: D4 : CTD - nafenopin-coenzyme A


Collection D4 : CTD
Chemical Name nafenopin-coenzyme A ( From PubChem : NAFENOPIN-COENZYME 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
1059.91 g/mol 9 26 4.3535 False(1/4)
Structure
InChI InChI=1S/C41H56N7O18P3S/c1-40(2,21-62-69(59,60)66-68(57,58)61-20-29-33(65-67(54,55)56)32(50)38(63-29)48-23-47-31-35(42)45-22-46-36(31)48)34(51)37(52)44-17-16-30(49)43-18-19-70-39(53)41(3,4)64-26-14-12-25(13-15-26)28-11-7-9-24-8-5-6-10-27(24)28/h5-6,8,10,12-15,22-23,28-29,32-34,38,50-51H,7,9,11,16-21H2,1-4H3,(H,43,49)(H,44,52)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56)/t28?,29-,32-,33-,34+,38-/m1/s1
InChIKey MUIWZLHYOXABMT-WFSMWQGZSA-N
Links

Gene (1 / 2)


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Source Type Unit Value Gene PMID Assay Other
CTDaffects(binding)GSTA1
C051515
CTDdecreases(activity)GSTA1
C051515
Download gene sets gmt, text, Detailed text
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