COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152003
Chemical Name: (5E)-5-[4-methoxy-2-methyl-5-(propan-2-yl)benzylidene]-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: COc1cc(C)c(cc1C(C)C)/C=C\1/SC(=O)N(C1=O)Cc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 426.49
Empirical Formula: C22H22N2O5S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.705
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 117
Number of rings: 3

     

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