COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK135382
Chemical Name: (2E)-2-{4-[(2-chloro-6-fluorobenzyl)oxy]benzylidene}-4,4-dimethyl-3-oxopentanenitrile
Smiles: N#C/C(=C\c1ccc(cc1)OCc1c(F)cccc1Cl)/C(=O)C(C)(C)C

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Molecular Weight: 371.84
Empirical Formula: C21H19ClFNO2

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 4.859
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 50
Number of rings: 2

     

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