COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL348007
Chemical Name: N-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1ccc(cc1)Cl

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Molecular Weight: 508.98
Empirical Formula: C25H21ClN4O4S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 7.476
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 5

     

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