COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056048
Chemical Name: ethyl5-acetyl-2-({(Z)-2-cyano-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cc3cc(ccc3oc2=O)[N+](=O)[O-])/C#N)sc(c1C)C(=O)C

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Molecular Weight: 550.57
Empirical Formula: C25H18N4O7S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.662
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 220
Number of rings: 4

     

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