COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK851348
Chemical Name: 4,5-dimethoxy-N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]-2-nitrobenzamide
Smiles: COc1cc(C(=O)/N=c/2\sc3c([nH]2)ccc(c3)S(=O)(=O)C)c(cc1OC)[N+](=O)[O-]

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Molecular Weight: 437.45
Empirical Formula: C17H15N3O7S2

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 2.219
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 173
Number of rings: 3

     

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