COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL382792
Chemical Name: 4-[(E)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl2-nitrobenzoate
Smiles: S=C1NC(=O)/C(=C\c2ccc(cc2)OC(=O)c2ccccc2[N+](=O)[O-])/S1

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Molecular Weight: 386.41
Empirical Formula: C17H10N2O5S2

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 2.615
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 158
Number of rings: 3

     

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