COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK583542
Chemical Name: 1-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-3,3-dimethylbutan-2-one
Smiles: COc1ccc(cc1)n1c(nnc1SCC(=O)C(C)(C)C)COc1ccc(cc1)C

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Molecular Weight: 425.55
Empirical Formula: C23H27N3O3S

Physical State: Dry powder
Available Amount: 163 mg

Lipinsky:
logP: 5.851
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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