COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK081302
Chemical Name: 2-[(2E)-2-{2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrobenzylidene}hydrazinyl]-1,3-benzothiazole
Smiles: [O-][N+](=O)c1ccc(c(c1)/C=N/Nc1nc2c(s1)cccc2)OCCOc1ccc(c(c1)C)C

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Molecular Weight: 462.53
Empirical Formula: C24H22N4O4S

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 6.715
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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