COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK644700
Chemical Name: 2-chloro-N-[(5E)-5-(4-hydroxy-3-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Smiles: S=C1S/C(=C/c2ccc(c(c2)[N+](=O)[O-])O)/C(=O)N1NC(=O)c1ccccc1Cl

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Molecular Weight: 435.87
Empirical Formula: C17H10ClN3O5S2

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 3.927
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 172
Number of rings: 3

     

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