COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK482092
Chemical Name: (2Z)-3-{3-[(5-fluoro-2-nitrophenoxy)methyl]-4-methoxyphenyl}-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)COc1cc(F)ccc1[N+](=O)[O-])OC)/S(=O)(=O)c1ccccc1

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Molecular Weight: 468.46
Empirical Formula: C23H17FN2O6S

Physical State: Dry powder
Available Amount: 334 mg

Lipinsky:
logP: 3.999
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 130
Number of rings: 3

     

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