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Gene Set: D4 : TTD - Relvar/Breo


Collection D4 : TTD
Chemical Name Relvar/Breo ( From PubChem : BREO ELLIPTA )
FDA NPC WHO Indian Australia China Traditional
Herbal
Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight
Hydrogen Bond
Donor Count
Hydrogen Bond
Acceptor Count
cLogP Lipinski Rule
1025.0 g/mol 5 13 9.9258 False(1/4)
Structure
InChI InChI=1S/C27H29F3O6S.C24H33Cl2NO5/c1-14-9-16-17-11-19(29)18-10-15(31)6-7-24(18,2)26(17,30)21(32)12-25(16,3)27(14,23(34)37-13-28)36-22(33)20-5-4-8-35-20;25-21-6-5-7-22(26)20(21)17-32-13-12-31-11-4-2-1-3-10-27-15-24(30)18-8-9-23(29)19(14-18)16-28/h4-8,10,14,16-17,19,21,32H,9,11-13H2,1-3H3;5-9,14,24,27-30H,1-4,10-13,15-17H2/t14-,16?,17?,19+,21+,24+,25+,26+,27+;24-/m10/s1
InChIKey IVFHIIPWLILHCX-NTENKBPOSA-N
Links

Gene (2 / 2)


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Source Type Unit Value Gene PMID Assay Other
TTDDrug(s)ADRB2Successful target
TTDDrug(s)NR3C1Successful target
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