COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK878478
Chemical Name: methyl4-({(E)-2-cyano-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: N#C/C(=C\Nc1ccc(cc1)C(=O)OC)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

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Molecular Weight: 474.45
Empirical Formula: C23H14N4O6S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.689
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 175
Number of rings: 4

     

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