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AI-942/40171331 is available in 5554 mg

Compound details
MDL #:		MFCD00006106
Formula:		C6 H9 N3
Weight:		123.16
Chiral info:		Not available
Name:		2,6-dimethyl-4-pyrimidinylamine
SMILES:		Cc1cc(N)nc(C)n1
InChI^TM:		InChI=1S/C6H9N3/c1-4-3-6(7)9-5(2)8-4/h3H,1-2H3,(H2,7,8,9)
InChIKey^TM:		BJJDXAFKCKSLTE-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		564 mg/Kg
Chronic LOAEL:		34.1 mg/Kg
Developmental Toxicity Potential:		0.01

Chemical properties calculations
LogP:	0.39	H-acceptors: 3
LogS:	-0.43	H-donors: 1
tPSA:	51.8 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.