COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK454925
Chemical Name: (2Z)-3-{5-[(4-chloro-3-methylphenoxy)methyl]furan-2-yl}-2-(phenylsulfonyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(o1)COc1ccc(c(c1)C)Cl)/S(=O)(=O)c1ccccc1

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Molecular Weight: 413.88
Empirical Formula: C21H16ClNO4S

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 5.323
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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