COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK825740
Chemical Name: (2Z,5Z)-5-[4-(benzyloxy)-5-methoxy-2-nitrobenzylidene]-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\S/C(=N\c3cc(C)cc(c3)C)/NC2=O)c(cc1OCc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 489.55
Empirical Formula: C26H23N3O5S

Physical State: Dry powder
Available Amount: 253 mg

Lipinsky:
logP: 4.824
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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