COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL036064
Chemical Name: N-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-methylpropanamide
Smiles: O=C(N(CC(=O)c1ccc(c(c1)O)O)C)CCN1C(=S)S/C(=C/c2ccco2)/C1=O

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Molecular Weight: 446.5
Empirical Formula: C20H18N2O6S2

Physical State: Dry powder
Available Amount: 38 mg

Lipinsky:
logP: 1.932
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 168
Number of rings: 3

     

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