COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK453951
Chemical Name: 1-(1,3-benzodioxol-5-yl)-3-(4H-1,2,4-triazol-4-yl)thiourea
Smiles: S=C(Nn1cnnc1)Nc1ccc2c(c1)OCO2

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Molecular Weight: 263.28
Empirical Formula: C10H9N5O2S

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 0.956
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 105
Number of rings: 3

     

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