COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418517
Chemical Name: (5E)-5-(3-hydroxy-4-methoxybenzylidene)-3-(4-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1O)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 388.42
Empirical Formula: C17H12N2O5S2

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 3.335
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 152
Number of rings: 3

     

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