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Gene Set: D4 : TTD - cyclo(-D-Tyr-D-Arg-L-Arg-L-MeNal-Gly-)

Collection D4 : TTD
Chemical Name cyclo(-D-Tyr-D-Arg-L-Arg-L-MeNal-Gly-) ( From PubChem : CHEMBL426169 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
743.855 g/mol 9 17 2.9033 False(1/4)
Structure
InChI InChI=1S/C37H49N11O6/c1-48-30(20-23-10-13-24-6-2-3-7-25(24)18-23)35(54)46-28(9-5-17-43-37(40)41)33(52)45-27(8-4-16-42-36(38)39)34(53)47-29(32(51)44-21-31(48)50)19-22-11-14-26(49)15-12-22/h2-3,6-7,10-15,18,27-30,49H,4-5,8-9,16-17,19-21H2,1H3,(H,44,51)(H,45,52)(H,46,54)(H,47,53)(H4,38,39,42)(H4,40,41,43)/t27-,28+,29-,30+/m1/s1
InChIKey XUKFERKCRCTLBJ-ATIZSFMBSA-N
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Gene (1 / 3)


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Source Type Unit Value Gene PMID Assay Other
TTDInhibitorCXCR4Successful target
TTDInhibitorCXCR4Successful target
TTDInhibitorCXCR4Successful target
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