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AG-690/40696707 is available in 23 mg

Compound details
MDL #:		MFCD02047992
Formula:		C21 H23 N3 O2 S
Weight:		381.5
Chiral info:		Not available
Name:		2-{[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
SMILES:		Cc1cccc(c1)NC(=O)CSc2nnc(o2)c3ccc(cc3)C(C)(C)C
InChI^TM:		InChI=1S/C21H23N3O2S/c1-14-6-5-7-17(12-14)22-18(25)13-27-20-24-23-19(26-20)15-8-10-16(11-9-15)21(2,3)4/h5-12H,13H2,1-4H3,(H,22,25)
InChIKey^TM:		YUBWQXRFRKVXLI-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		2850 mg/Kg
Chronic LOAEL:		9.87 mg/Kg

Chemical properties calculations
LogP:	4.48	H-acceptors: 4
LogS:	-5.8	H-donors: 1
tPSA:	93.32 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.