COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019246
Chemical Name: (2E)-N-(5-benzyl-1,3-thiazol-2-yl)-3-(4-butoxy-3-methoxyphenyl)-2-cyanoprop-2-enamide
Smiles: CCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1ncc(s1)Cc1ccccc1)\C#N

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Molecular Weight: 447.56
Empirical Formula: C25H25N3O3S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.985
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 3

     

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