COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK178034
Chemical Name: (5E)-5-[4-(2,4-dinitrophenoxy)-3-methoxybenzylidene]-3-(propan-2-yl)-1,3-thiazolidine-2,4-dione
Smiles: COc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C\1/SC(=O)N(C1=O)C(C)C

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Molecular Weight: 459.44
Empirical Formula: C20H17N3O8S

Physical State: Dry powder
Available Amount: 739 mg

Lipinsky:
logP: 3.102
Rotatable bonds: 5
H-donors: 0
H-acceptors: 8
PSA: 172
Number of rings: 3

     

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