COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522892
Chemical Name: (2E)-3-{3-[(2-chlorobenzyl)oxy]-4-methoxyphenyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)OCc1ccccc1Cl)OC)/C(=O)Nc1cc(ccc1Cl)C(F)(F)F

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Molecular Weight: 521.32
Empirical Formula: C25H17Cl2F3N2O3

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 7.394
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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