COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042442
Chemical Name: 2-{[4-(4-chlorophenyl)-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethanone
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)c1ccc(c(c1)O)O

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Molecular Weight: 467.93
Empirical Formula: C23H18ClN3O4S

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 6.476
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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