COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK200949
Chemical Name: (2E)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-(4-fluorophenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1cc2OCOc2cc1Cl)/c1ccc(cc1)F

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Molecular Weight: 301.7
Empirical Formula: C16H9ClFNO2

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 5.126
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 3

     

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