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AG-690/36652042 is available in 53 mg

Compound details
MDL #:		MFCD00749321
Formula:		C16 H23 N3 O S
Weight:		305.44
Salt Data:		HBr
Chiral info:		Not available
Name:		5,5,6-trimethylbicyclo[2.2.1]heptan-2-one (5-acetyl-4-methyl-1,3-thiazol-2-yl)hydrazone
SMILES:		CC(=O)c3c(C)nc(NN=C2CC1CC2(C(C)C1(C)(C)))s3
InChI^TM:		InChI=1S/C16H23N3OS/c1-8-12-6-11(16(8,4)5)7-13(12)18-19-15-17-9(2)14(21-15)10(3)20/h8,11-12H,6-7H2,1-5H3,(H,17,19)
InChIKey^TM:		BDAWXLVCNJCAEV-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		0.066 mg/Kg
Chronic LOAEL:		247 mg/Kg

Chemical properties calculations
LogP:	4.91	H-acceptors: 4
LogS:	-5.62	H-donors: 1
tPSA:	82.59 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.