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AE-508/21131018 is available in 3408 mg

Compound details
Formula:		C21 H26 N2 O3
Weight:		354.45
Chiral info:		Compound is marked as Chiral
Name:		Yohimbine
SMILES:		[H]C25(CCC(O)C(C(=O)OC)C5([H])(CC3([H])(c4[nH]c1ccccc1c4(CCN3(C2)))))
InChI^TM:		InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3
InChIKey^TM:		BLGXFZZNTVWLAY-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		0.397 mg/Kg
Chronic LOAEL:		110 mg/Kg

Chemical properties calculations
LogP:	2.73	H-acceptors: 5
LogS:	-3.11	H-donors: 2
tPSA:	65.56 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.