COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL290891
Chemical Name: 4-chloro-2-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-(2-hydroxyethyl)hydrazinylidene]methyl}-5-methoxyphenol
Smiles: OCCN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c1cc(Cl)c(cc1O)OC

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Molecular Weight: 409.85
Empirical Formula: C17H16ClN3O5S

Physical State: Dry powder
Available Amount: 894 mg

Lipinsky:
logP: 3.144
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 112
Number of rings: 3

     

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