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Gene Set: D4 : TTD - E-6276

Collection D4 : TTD
Chemical Name E-6276 ( From PubChem : UNII-BGU9MZ2G30 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
350.411 g/mol 1 5 3.1102 True
Structure
InChI InChI=1S/C21H22N2O3/c24-21(25)19-12-7-13-23(16-19)14-15-26-22-20(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-12H,7,13-16H2,(H,24,25)
InChIKey NGNALWDRPKNJGR-UHFFFAOYSA-N
Links

Gene (3 / 9)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDDrug(s)SIGMAR1Successful target
PubChem PotencyuM10.000CYP2C19-GI(Protien) :
PubChem NoneuMCYP2C19-GI(Protien) :
PubChem PotencyuM0.006CYP2D6-GI(Protien) :
PubChem NoneuMCYP2D6-GI(Protien) :
ChEMBLAC50nM10000.000CYP2C19
-Target : CHEMBL3622
ChEMBLPotencynM10000.000CYP2C19
-Target : CHEMBL3622
ChEMBLAC50nM6.310CYP2D6
-Target : CHEMBL289
ChEMBLPotencynM6.300CYP2D6
-Target : CHEMBL289
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