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Gene Set: D4 : CTD - nolatrexed

Collection D4 : CTD
Chemical Name nolatrexed ( From PubChem : NOLATREXED DIHYDROCHLORIDE )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
357.258 g/mol 4 5 4.5451 True
Structure
InChI InChI=1S/C14H12N4OS.2ClH/c1-8-2-3-10-11(13(19)18-14(15)17-10)12(8)20-9-4-6-16-7-5-9;;/h2-7H,1H3,(H3,15,17,18,19);2*1H
InChIKey PJKVJJYMWOCLIJ-UHFFFAOYSA-N
Links

Gene (8 / 11)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
CTDaffects(response to substance)TP53
C099178
CTDdecreases(activity)TYMS
C099178
CTDaffects(response to substance)TYMS
C099178
PubChem Potency-Replicate_1uM13.333AHR-GI(Protien) :
PubChem AhR Potency (uM)uM13.333AHR-GI(Protien) :
PubChem Potency-Replicate_1uM9.439CYP19A1-GI(Protien) :
PubChem Potency-Replicate_1uM2.371ESR1-GI(Protien) :
PubChem ER Potency (uM)uM7.498ESR1-GI(Protien) :
PubChem Ratio Potency (uM)uM19.569NFE2L2-GI(Protien) :
PubChem NoneuMNR3C1-GI(Protien) :
PubChem PotencyuM0.376TDP1-GI(Protien) :
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