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AI-204/31729063 is available in 33 mg

Compound details
MDL #:		MFCD01416297
Formula:		C10 H6 Br N O4
Weight:		284.06
Chiral info:		Not available
Name:		(5-bromo-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetic acid
SMILES:		OC(=O)CN2C(=O)C(=O)c1cc(ccc12)Br
InChI^TM:		InChI=1S/C10H6BrNO4/c11-5-1-2-7-6(3-5)9(15)10(16)12(7)4-8(13)14/h1-3H,4H2,(H,13,14)
InChIKey^TM:		FXMWOVGFJGGHLE-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		76 mg/Kg
Chronic LOAEL:		17 mg/Kg
AMES Mutagenicity:		1

Chemical properties calculations
LogP:	0.42	H-acceptors: 5
LogS:	-1.63	H-donors: 1
tPSA:	74.68 Å²	Rotatable bonds: 2

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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.