COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK050810
Chemical Name: 2-[(2E)-2-(5-bromo-2,3-dimethoxybenzylidene)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]ethanol
Smiles: OCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1cc(Br)cc(c1OC)OC

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Molecular Weight: 468.33
Empirical Formula: C18H18BrN3O5S

Physical State: Dry powder
Available Amount: 660 mg

Lipinsky:
logP: 2.91
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 3

     

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