COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL226809
Chemical Name: 1-(1,3-benzodioxol-5-yl)-2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(c1ccc2c(c1)OCO2)CSc1nnc(n1c1ccccc1)c1cccnc1

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Molecular Weight: 416.46
Empirical Formula: C22H16N4O3S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 4.87
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 104
Number of rings: 5

     

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