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AJ-292/21122012 is available in 1 mg

Compound details
Formula:		C19 H20 N O2
Weight:		294.37
Salt Data:		I-
Chiral info:		Not available
Name:		Roemerine methiodide
SMILES:		C[N+]4(C)(CCc2cc1OCOc1c3c5ccccc5(CC4(c23)))
InChI^TM:		InChI=1S/C19H20NO2/c1-20(2)8-7-13-10-16-19(22-11-21-16)18-14-6-4-3-5-12(14)9-15(20)17(13)18/h3-6,10,15H,7-9,11H2,1-2H3/q+1
InChIKey^TM:		NXTWYDPQNKVDLP-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		17 mg/Kg
AMES Mutagenicity:		1
Developmental Toxicity Potential:		1

Chemical properties calculations
LogP:	3.06
LogS:	-5.07
tPSA:	18.46 Å²	Rotatable bonds: 0

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Disclaimer: Predicted physical and biological properties, such as toxicity, mentioned on this website are indicative only and may not be relied upon in any way. Liability for damages of any kind resulting from reliance on these properties is expressly rejected.