COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017061
Chemical Name: (2E)-N-[5-(2-chlorobenzyl)-1,3-thiazol-2-yl]-2-cyano-3-[4-(hexyloxy)phenyl]prop-2-enamide
Smiles: CCCCCCOc1ccc(cc1)/C=C(/C(=O)Nc1ncc(s1)Cc1ccccc1Cl)\C#N

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Molecular Weight: 480.03
Empirical Formula: C26H26ClN3O2S

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 7.761
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 3

     

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