COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122922
Chemical Name: 1-(4-chlorophenyl)-2-({4-ethyl-5-[(3-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: CCn1c(SCC(=O)c2ccc(cc2)Cl)nnc1COc1cccc(c1)C

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Molecular Weight: 401.92
Empirical Formula: C20H20ClN3O2S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 5.447
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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