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AJ-333/15478091 is available in 552 mg

Compound details
MDL #:		MFCD02325736
Formula:		C16 H24 N4 O3 S
Weight:		352.46
Chiral info:		Not available
Name:		4-(bicyclo[2.2.1]hept-2-ylamino)-3-({[(isopropylamino)carbonyl]amino}sulfonyl)pyridine
SMILES:		CC(C)NC(=O)NS(=O)(=O)c3cnccc3(NC2CC1CCC2(C1))
InChI^TM:		InChI=1S/C16H24N4O3S/c1-10(2)18-16(21)20-24(22,23)15-9-17-6-5-13(15)19-14-8-11-3-4-12(14)7-11/h5-6,9-12,14H,3-4,7-8H2,1-2H3,(H,17,19)(H2,18,20,21)
InChIKey^TM:		KUUDCXGUWLYZPK-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		4 mg/Kg
Chronic LOAEL:		34 mg/Kg
Developmental Toxicity Potential:		0.81

Chemical properties calculations
LogP:	1.9	H-acceptors: 7
LogS:	-3.39	H-donors: 3
tPSA:	108.57 Å²	Rotatable bonds: 7

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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.