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AF-399/41753391 is available in 129 mg

Compound details
MDL #:		MFCD03759718
Formula:		C11 H9 F N S2
Weight:		238.33
Salt Data:		Br-
Chiral info:		Not available
Name:		5-(4-fluorophenyl)-2,3-dihydro[1,3]thiazolo[2,3-b][1,3]thiazol-4-ium
SMILES:		Fc1ccc(cc1)c3csc2[n+]3(CCS2)
InChI^TM:		InChI=1S/C11H9FNS2/c12-9-3-1-8(2-4-9)10-7-15-11-13(10)5-6-14-11/h1-4,7H,5-6H2/q+1
InChIKey^TM:		BQJJHBGYVBPLIR-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		2800 mg/Kg
Chronic LOAEL:		81.1 mg/Kg
AMES Mutagenicity:		1

Chemical properties calculations
LogP:	0.47
LogS:	-1.35
tPSA:	57.42 Å²	Rotatable bonds: 1

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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.