COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522883
Chemical Name: (2E)-N-[4-(acetylamino)phenyl]-2-cyano-3-{3,5-dichloro-4-[(2-chlorobenzyl)oxy]phenyl}prop-2-enamide
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)Cl)OCc1ccccc1Cl)/C(=O)Nc1ccc(cc1)NC(=O)C

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Molecular Weight: 514.79
Empirical Formula: C25H18Cl3N3O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.167
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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