COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK767605
Chemical Name: ethyl3,5,6-trichloro-4-[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]pyridine-2-carboxylate
Smiles: CCOC(=O)c1nc(Cl)c(c(c1Cl)Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cl

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Molecular Weight: 490.88
Empirical Formula: C22H26Cl3NO3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.472
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 2

     

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