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Gene Set: D4 : TTD - AdcAhxArg4Lys(biotin)-PEG-OMe

Collection D4 : TTD
Chemical Name AdcAhxArg4Lys(biotin)-PEG-OMe ( From PubChem : CHEMBL413173 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
1474.74 g/mol 21 42 3.1026 False(1/4)
Structure
InChI InChI=1S/C61H107N27O14S/c1-100-29-30-101-28-27-73-50(93)34(13-6-8-21-71-41(89)19-5-4-18-40-43-39(31-103-40)86-61(99)87-43)82-52(95)36(15-10-24-75-58(65)66)84-54(97)38(17-12-26-77-60(69)70)85-53(96)37(16-11-25-76-59(67)68)83-51(94)35(14-9-23-74-57(63)64)81-42(90)20-3-2-7-22-72-55(98)47-45(91)46(92)56(102-47)88-33-80-44-48(62)78-32-79-49(44)88/h32-40,43,45-47,56,91-92H,2-31H2,1H3,(H,71,89)(H,72,98)(H,73,93)(H,81,90)(H,82,95)(H,83,94)(H,84,97)(H,85,96)(H2,62,78,79)(H4,63,64,74)(H4,65,66,75)(H4,67,68,76)(H4,69,70,77)(H2,86,87,99)/t34?,35-,36-,37-,38-,39?,40-,43?,45-,46+,47-,56+/m0/s1
InChIKey HKRIJYTUBFTJDB-CIYLPTNUSA-N
Links

Gene (2 / 2)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDInhibitorPRKAR1AResearch target
TTDInhibitorPRKAR2BResearch target
Download gene sets gmt, text, Detailed text
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