COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL016987
Chemical Name: (2E)-N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-3-[5-chloro-2-(prop-2-en-1-yloxy)phenyl]-2-cyanoprop-2-enamide
Smiles: C=CCOc1ccc(cc1/C=C(/C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C)\C#N)Cl

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Molecular Weight: 484.41
Empirical Formula: C24H19Cl2N3O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.126
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 3

     

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