COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK756360
Chemical Name: 2-ethoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl2,4-dinitrobenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)C

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Molecular Weight: 489.49
Empirical Formula: C20H15N3O8S2

Physical State: Dry powder
Available Amount: 38 mg

Lipinsky:
logP: 3.155
Rotatable bonds: 6
H-donors: 0
H-acceptors: 8
PSA: 204
Number of rings: 3

     

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