COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL276347
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-ethyl-5-(1-ethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: CCn1c(SCC(=O)c2ccc3c(c2)OCCO3)nnc1c1cnn(c1)CC

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Molecular Weight: 399.47
Empirical Formula: C19H21N5O3S

Available Amount: 0 mg

Lipinsky:
logP: 3.859
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 4

     

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