COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035569
Chemical Name: (5E)-3-[(2,4-dinitrophenyl)amino]-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])cc(c1OC)OC

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Molecular Weight: 492.49
Empirical Formula: C19H16N4O8S2

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 4.514
Rotatable bonds: 3
H-donors: 1
H-acceptors: 8
PSA: 209
Number of rings: 3

     

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