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AG-690/09906022 is available in 15 mg

Compound details
MDL #:		MFCD00684400
Formula:		C15 H10 N2 O4
Weight:		282.25
Chiral info:		Not available
Name:		1-({3-nitrophenyl}methyl)-1H-indole-2,3-dione
SMILES:		O=C2C(=O)N(Cc1cccc(c1)[N+](=O)[O-])c3ccccc23
InChI^TM:		InChI=1S/C15H10N2O4/c18-14-12-6-1-2-7-13(12)16(15(14)19)9-10-4-3-5-11(8-10)17(20)21/h1-8H,9H2
InChIKey^TM:		VTCUAJNKKBKMFZ-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		2760 mg/Kg
Developmental Toxicity Potential:		0.71

Chemical properties calculations
LogP:	1.8	H-acceptors: 3
LogS:	-3.19
tPSA:	80.52 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.