COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL290911
Chemical Name: 2-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)-2-methylhydrazinylidene]methyl}-6-methoxy-4-nitrophenol
Smiles: COc1cc(cc(c1O)/C=N/N(C1=NS(=O)(=O)c2c1cccc2)C)[N+](=O)[O-]

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Molecular Weight: 390.38
Empirical Formula: C16H14N4O6S

Physical State: Dry powder
Available Amount: 952 mg

Lipinsky:
logP: 2.884
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 137
Number of rings: 3

     

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