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Gene Set: D4 : CTD - methotrexate-alpha glutamate

Collection D4 : CTD
Chemical Name methotrexate-alpha glutamate ( From PubChem : 71074-49-2 )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
583.553 g/mol 7 17 1.5622 False(1/4)
Structure
InChI InChI=1S/C25H29N9O8/c1-34(11-13-10-28-21-19(29-13)20(26)32-25(27)33-21)14-4-2-12(3-5-14)22(39)30-15(6-8-17(35)36)23(40)31-16(24(41)42)7-9-18(37)38/h2-5,10,15-16H,6-9,11H2,1H3,(H,30,39)(H,31,40)(H,35,36)(H,37,38)(H,41,42)(H4,26,27,28,32,33)
InChIKey GCHKEUJNMCBNBS-UHFFFAOYSA-N
Links

Gene (1 / 2)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
CTDincreases(export)ABCG2
C042921
CTDincreases(reaction)ABCG2
C042921
Download gene sets gmt, text, Detailed text
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