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Gene Set: D4 : CTD - carbetapentane

Collection D4 : CTD
Chemical Name carbetapentane ( From PubChem : CARBETAPENTANE )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotApprovedNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
333.465 g/mol 0 4 3.4 True
Structure
InChI InChI=1S/C20H31NO3/c1-3-21(4-2)14-15-23-16-17-24-19(22)20(12-8-9-13-20)18-10-6-5-7-11-18/h5-7,10-11H,3-4,8-9,12-17H2,1-2H3
InChIKey CFJMRBQWBDQYMK-UHFFFAOYSA-N
Links

Gene (4 / 8)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
CTDdecreases(activity)KCNH2
C018861
PubChem PotencyuM10.000CYP2D6-GI(Protien) :
PubChem NoneuMCYP2D6-GI(Protien) :
PubChem PotencyuM29.935EHMT2-GI(Protien) :
PubChem PotencyuM29.855TDP1-GI(Protien) :
ChEMBLAC50nM10000.000CYP2D6
-Target : CHEMBL289
ChEMBLPotencynM10000.000CYP2D6
-Target : CHEMBL289
ChEMBLPotencynM29934.900EHMT2
-Target : CHEMBL6032
Download gene sets gmt, text, Detailed text
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