COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK154845
Chemical Name: (5E)-3-(butan-2-yl)-5-{4-[(5-nitropyridin-2-yl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione
Smiles: CCC(N1C(=O)S/C(=C/c2ccc(cc2)Oc2ccc(cn2)[N+](=O)[O-])/C1=O)C

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Molecular Weight: 399.43
Empirical Formula: C19H17N3O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.809
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 130
Number of rings: 3

     

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