COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153644
Chemical Name: (2Z,5Z)-2-[(3,5-dimethylphenyl)imino]-5-{3-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazolidin-4-one
Smiles: COc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C/1\S/C(=N\c2cc(C)cc(c2)C)/NC1=O

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Molecular Weight: 489.55
Empirical Formula: C26H23N3O5S

Physical State: Dry powder
Available Amount: 450 mg

Lipinsky:
logP: 4.533
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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