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Gene Set: D4 : TTD - OM00-3

Collection D4 : TTD
Chemical Name OM00-3 ( From PubChem : CHEMBL390456 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
936.057 g/mol 12 22 2.9351 False(1/4)
Structure
InChI InChI=1S/C44H69N7O15/c1-22(2)17-29(47-42(63)31(21-36(57)58)49-41(62)30(18-23(3)4)48-39(60)27(45)13-15-34(53)54)33(52)19-25(7)38(59)51-37(24(5)6)43(64)46-28(14-16-35(55)56)40(61)50-32(44(65)66)20-26-11-9-8-10-12-26/h8-12,22-25,27-33,37,52H,13-21,45H2,1-7H3,(H,46,64)(H,47,63)(H,48,60)(H,49,62)(H,50,61)(H,51,59)(H,53,54)(H,55,56)(H,57,58)(H,65,66)/t25-,27+,28+,29+,30+,31+,32+,33+,37+/m1/s1
InChIKey CFIWWTUUSMMDDA-IQRKPKHNSA-N
Links

Gene (1 / 2)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDInhibitorBACE1Clinical trial target
TTDDrug(s)BACE1Clinical trial target
Download gene sets gmt, text, Detailed text
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