COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042938
Chemical Name: 2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(naphthalen-2-yl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1COc1ccc(cc1)C

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Molecular Weight: 495.6
Empirical Formula: C29H25N3O3S

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 7.566
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 5

     

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