COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417991
Chemical Name: 4-{(E)-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]methyl}-2-methoxyphenyl4-nitrobenzoate
Smiles: COc1cc(/C=N/Nc2nc3c(s2)cccc3)ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 448.46
Empirical Formula: C22H16N4O5S

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 5.958
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 146
Number of rings: 4

     

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