COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807849
Chemical Name: 2-({5-[(1,3-benzodioxol-5-yloxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
Smiles: COc1ccc(cc1)n1c(COc2ccc3c(c2)OCO3)nnc1SCC(=O)c1ccccc1

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Molecular Weight: 475.52
Empirical Formula: C25H21N3O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.736
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 110
Number of rings: 5

     

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