DSigDB

Drug SIGnatures DataBase Collection of Annoated Drug / Compound Gene Sets

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Gene Set: D4 : CTD - 1,1,1-trichloro-2-(4-hydroxyphenyl)-2-(4-methoxyphenyl)ethane

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Collection	D4 : CTD
Chemical Name	1,1,1-trichloro-2-(4-hydroxyphenyl)-2-(4-methoxyphenyl)ethane ( From PubChem : MONOHYDROXYMETHOXYCHLOR )
FDA NPC WHO Indian Australia China Traditional Herbal Clinical Trail Not Not Not Not Not Not Not Not
Molecular Weight Hydrogen Bond Donor Count Hydrogen Bond Acceptor Count cLogP Lipinski Rule 331.622 g/mol 1 2 4.9029 True
Structure
InChI	InChI=1S/C15H13Cl3O2/c1-20-13-8-4-11(5-9-13)14(15(16,17)18)10-2-6-12(19)7-3-10/h2-9,14,19H,1H3/t14-/m1/s1
InChIKey	BUZUQNXGKRJIJT-CQSZACIVSA-N
Links
Gene (10 / 13) ⊖ Less	Source Type Unit Value Gene PMID Assay Other CTD increases(chemical synthesis) CYP1A2 C495657 CTD increases(hydroxylation) CYP1A2 C495657 CTD increases(chemical synthesis) CYP2A6 C495657 CTD increases(chemical synthesis) CYP2B6 C495657 CTD increases(hydroxylation) CYP2B6 C495657 CTD increases(chemical synthesis) CYP2C18 C495657 CTD increases(chemical synthesis) CYP2C19 C495657 CTD increases(hydroxylation) CYP2C19 C495657 CTD increases(chemical synthesis) CYP2C9 C495657 CTD increases(hydroxylation) CYP2D6 C495657 CTD increases(hydroxylation) CYP2E1 C495657 CTD increases(hydroxylation) CYP3A4 C495657 CTD increases(hydroxylation) CYP3A5 C495657
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