COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807100
Chemical Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-5-[(2-phenylethyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Cn1c(SCCc2ccccc2)nnc1c1ccc2c(c1)OCO2

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Molecular Weight: 339.42
Empirical Formula: C18H17N3O2S

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 4.469
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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