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Gene Set: D4 : TTD - Ac-YR[CEH(pF-dF)RWC]-NH2


Collection D4 : TTD
Chemical Name Ac-YR[CEH(pF-dF)RWC]-NH2 ( From PubChem : CHEMBL407809 )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
1356.51 g/mol 18 32 3.8887 False(1/4)
Structure
InChI InChI=1S/C60H78FN19O13S2/c1-31(81)72-43(22-33-12-16-37(82)17-13-33)54(89)73-41(9-5-21-69-60(65)66)52(87)80-48-29-95-94-28-47(50(62)85)79-56(91)45(24-34-26-70-39-7-3-2-6-38(34)39)77-51(86)40(8-4-20-68-59(63)64)74-55(90)44(23-32-10-14-35(61)15-11-32)76-57(92)46(25-36-27-67-30-71-36)78-53(88)42(75-58(48)93)18-19-49(83)84/h2-3,6-7,10-17,26-27,30,40-48,70,82H,4-5,8-9,18-25,28-29H2,1H3,(H2,62,85)(H,67,71)(H,72,81)(H,73,89)(H,74,90)(H,75,93)(H,76,92)(H,77,86)(H,78,88)(H,79,91)(H,80,87)(H,83,84)(H4,63,64,68)(H4,65,66,69)/t40-,41-,42+,43-,44-,45+,46-,47+,48+/m0/s1
InChIKey CHBTZNAADZTZLP-XVRHLUALSA-N
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Gene (3 / 3)


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Source Type Unit Value Gene PMID Assay Other
TTDInhibitorMC1RResearch target
TTDInhibitorMC3RResearch target
TTDInhibitorMC4RClinical trial target
Download gene sets gmt, text, Detailed text
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