COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK536344
Chemical Name: 2-{[4-(2-chlorophenyl)-3-cyano-6-hydroxy-5-(thiophen-2-ylcarbonyl)-6-(trifluoromethyl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(C(N1)(O)C(F)(F)F)C(=O)c1cccs1)c1ccccc1Cl

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Molecular Weight: 622.09
Empirical Formula: C28H23ClF3N3O4S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 8.975
Rotatable bonds: 8
H-donors: 3
H-acceptors: 4
PSA: 164
Number of rings: 4

     

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