COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417004
Chemical Name: 1-(3-chlorophenyl)-3-{(5E)-4-oxo-5-[(4-oxo-4H-chromen-3-yl)methylidene]-2-thioxo-1,3-thiazolidin-3-yl}urea
Smiles: O=C(NN1C(=S)S/C(=C/c2coc3c(c2=O)cccc3)/C1=O)Nc1cccc(c1)Cl

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Molecular Weight: 457.92
Empirical Formula: C20H12ClN3O4S2

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 3.281
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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