COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK992392
Chemical Name: (2Z)-2-(4-ethylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl4-chlorobenzenesulfonate
Smiles: CCc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)Cl

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Molecular Weight: 440.9
Empirical Formula: C23H17ClO5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.218
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 78
Number of rings: 4

     

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