COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL168489
Chemical Name: 1-(1,3-benzodioxol-5-yl)-2-[(5-{(2E)-2-[1-(4-fluorophenyl)ethylidene]hydrazinyl}-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Smiles: Fc1ccc(cc1)/C(=N/Nc1nnc([nH]1)SCC(=O)c1ccc2c(c1)OCO2)/C

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Molecular Weight: 413.43
Empirical Formula: C19H16FN5O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.444
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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