COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455130
Chemical Name: (2E)-3-{3-[(4-fluorobenzyl)oxy]-4-methoxyphenyl}-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)OCc1ccc(cc1)F)OC)/S(=O)(=O)c1ccccc1

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Molecular Weight: 423.46
Empirical Formula: C23H18FNO4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.519
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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