COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL338685
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylphenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)C)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 471.62
Empirical Formula: C28H29N3O2S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 8.596
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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