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Gene Set: D4 : TTD - Ac-YRC(Me)*EHdFRWC(Me)NH2

Collection D4 : TTD
Chemical Name Ac-YRC(Me)*EHdFRWC(Me)NH2 ( From PubChem : CHEMBL427666 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
1368.59 g/mol 18 32 4.4532 False(1/4)
Structure
InChI InChI=1S/C62H85N19O13S2/c1-34(82)73-45(26-36-17-19-39(83)20-18-36)56(90)74-43(16-10-24-70-62(66)67)54(88)81-50(32-96-3)60(94)76-44(21-22-51(84)85)55(89)79-48(28-38-30-68-33-72-38)59(93)77-46(25-35-11-5-4-6-12-35)57(91)75-42(15-9-23-69-61(64)65)53(87)78-47(58(92)80-49(31-95-2)52(63)86)27-37-29-71-41-14-8-7-13-40(37)41/h4-8,11-14,17-20,29-30,33,42-50,71,83H,9-10,15-16,21-28,31-32H2,1-3H3,(H2,63,86)(H,68,72)(H,73,82)(H,74,90)(H,75,91)(H,76,94)(H,77,93)(H,78,87)(H,79,89)(H,80,92)(H,81,88)(H,84,85)(H4,64,65,69)(H4,66,67,70)/t42-,43-,44-,45-,46+,47-,48-,49-,50-/m0/s1
InChIKey PWVUYOZSIWYFJW-MYBKRMQRSA-N
Links

Gene (3 / 3)


⊖ Less
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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