COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL409845
Chemical Name: methyl3-(5-hydroxy-2,1,3-benzothiadiazol-4-yl)-3-[4-(methylsulfanyl)phenyl]propanoate
Smiles: COC(=O)CC(c1c(O)ccc2c1nsn2)c1ccc(cc1)SC

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Molecular Weight: 360.46
Empirical Formula: C17H16N2O3S2

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.273
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 125
Number of rings: 3

     

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