COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK257180
Chemical Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Smiles: Cn1c(SCCOc2ccc(c(c2)C)C)nnc1c1ccc2c(c1)OCCO2

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Molecular Weight: 397.5
Empirical Formula: C21H23N3O3S

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 5.868
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 83
Number of rings: 4

     

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