COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK408858
Chemical Name: (2Z)-3-{3-methoxy-2-[(4-methylbenzyl)oxy]phenyl}-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1cccc(c1OCc1ccc(cc1)C)OC)/S(=O)(=O)c1ccccc1

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Molecular Weight: 419.5
Empirical Formula: C24H21NO4S

Physical State: Dry powder
Available Amount: 492 mg

Lipinsky:
logP: 4.987
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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