COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL168498
Chemical Name: 1-(1,3-benzodioxol-5-yl)-2-[(5-{(2E)-2-[1-(3-methoxyphenyl)ethylidene]hydrazinyl}-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Smiles: COc1cccc(c1)/C(=N/Nc1nnc([nH]1)SCC(=O)c1ccc2c(c1)OCO2)/C

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Molecular Weight: 425.47
Empirical Formula: C20H19N5O4S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 3.389
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 136
Number of rings: 4

     

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