COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110822
Chemical Name: 2-[(2E)-2-{2-[2-(3,5-dimethylphenoxy)ethoxy]-5-nitrobenzylidene}hydrazinyl]-1,3-benzothiazole
Smiles: Cc1cc(OCCOc2ccc(cc2/C=N/Nc2nc3c(s2)cccc3)[N+](=O)[O-])cc(c1)C

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Molecular Weight: 462.53
Empirical Formula: C24H22N4O4S

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.715
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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