COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807881
Chemical Name: 3-[(1,3-benzodioxol-5-yloxy)methyl]-5-(benzylsulfanyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(nnc1SCc1ccccc1)COc1ccc2c(c1)OCO2

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Molecular Weight: 447.51
Empirical Formula: C24H21N3O4S

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 6.034
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 92
Number of rings: 5

     

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