COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK554694
Chemical Name: 4-nitro-N-[(5Z)-4-oxo-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-3-yl]benzamide
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)NC(=O)c2ccc(cc2)[N+](=O)[O-])cc(c1OC)OC

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Molecular Weight: 475.5
Empirical Formula: C20H17N3O7S2

Physical State: Dry powder
Available Amount: 355 mg

Lipinsky:
logP: 3.443
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 180
Number of rings: 3

     

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