COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK005069
Chemical Name: ethyl(2E)-2-cyano-3-{3-methoxy-4-[(phenylsulfonyl)oxy]phenyl}prop-2-enoate
Smiles: CCOC(=O)/C(=C/c1ccc(c(c1)OC)OS(=O)(=O)c1ccccc1)/C#N

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Molecular Weight: 387.41
Empirical Formula: C19H17NO6S

Physical State: Dry powder
Available Amount: 253 mg

Lipinsky:
logP: 2.826
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 111
Number of rings: 2

     

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