COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034820
Chemical Name: (5Z)-5-{2-[2-(4-chloro-3-methylphenoxy)ethoxy]-5-nitrobenzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C\c2cc(ccc2OCCOc2ccc(c(c2)C)Cl)[N+](=O)[O-])/C1=O

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Molecular Weight: 490.99
Empirical Formula: C22H19ClN2O5S2

Physical State: Dry powder
Available Amount: 211 mg

Lipinsky:
logP: 5.629
Rotatable bonds: 8
H-donors: 0
H-acceptors: 5
PSA: 141
Number of rings: 3

     

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