COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK122366
Chemical Name: ethyl(2Z)-2-cyano-3-{3,5-dibromo-4-[(4-chlorobenzyl)oxy]phenyl}prop-2-enoate
Smiles: CCOC(=O)/C(=C\c1cc(Br)c(c(c1)Br)OCc1ccc(cc1)Cl)/C#N

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Molecular Weight: 499.59
Empirical Formula: C19H14Br2ClNO3

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 5.774
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 2

     

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