COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017074
Chemical Name: (2E)-2-cyano-N-[5-(3,4-dichlorobenzyl)-1,3-thiazol-2-yl]-3-(4-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1ccc(cc1)/C=C(/C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)Cl)\C#N

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Molecular Weight: 458.37
Empirical Formula: C22H17Cl2N3O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.106
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 3

     

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