COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK460164
Chemical Name: methyl(2Z)-3-{3-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-2-cyanoprop-2-enoate
Smiles: COC(=O)/C(=C\c1cccc(c1)OCc1c(F)cccc1Cl)/C#N

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Molecular Weight: 345.76
Empirical Formula: C18H13ClFNO3

Physical State: Dry powder
Available Amount: 452 mg

Lipinsky:
logP: 3.665
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 2

     

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