COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054424
Chemical Name: 2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(c(c2)O)O)nnc1c1ccccc1Cl

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Molecular Weight: 481.96
Empirical Formula: C24H20ClN3O4S

Physical State: Dry powder
Available Amount: 225 mg

Lipinsky:
logP: 6.771
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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