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AJ-333/25006220 is available in 1577 mg

Compound details
MDL #:		MFCD00661418
Formula:		C9 H11 Cl N2 O
Weight:		198.65
Chiral info:		Not available
Name:		6-chloro-N-isopropylnicotinamide
SMILES:		CC(C)NC(=O)c1ccc(nc1)Cl
InChI^TM:		InChI=1S/C9H11ClN2O/c1-6(2)12-9(13)7-3-4-8(10)11-5-7/h3-6H,1-2H3,(H,12,13)
InChIKey^TM:		RALGDACVBSBFMU-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		721 mg/Kg
Developmental Toxicity Potential:		1

Chemical properties calculations
LogP:	1.57	H-acceptors: 3
LogS:	-1.99	H-donors: 1
tPSA:	41.99 Å²	Rotatable bonds: 3

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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.