COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807864
Chemical Name: 2-({5-[(1,3-benzodioxol-5-yloxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(3-nitrophenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2cccc(c2)[N+](=O)[O-])nnc1COc1ccc2c(c1)OCO2

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Molecular Weight: 520.52
Empirical Formula: C25H20N4O7S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.561
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 155
Number of rings: 5

     

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