COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL276430
Chemical Name: 6-(1,3-benzodioxol-5-ylamino)-3-[(3,4-dimethoxybenzyl)sulfanyl]-4-ethyl-1,2,4-triazin-5(4H)-one
Smiles: COc1cc(CSc2nnc(c(=O)n2CC)Nc2ccc3c(c2)OCO3)ccc1OC

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Molecular Weight: 442.5
Empirical Formula: C21H22N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 2.695
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 119
Number of rings: 4

     

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