COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK787683
Chemical Name: 3-(1,3-benzodioxol-5-yl)-6-[(E)-2-(4-chlorophenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Clc1ccc(cc1)/C=C/c1sc2n(n1)c(nn2)c1ccc2c(c1)OCO2

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Molecular Weight: 382.83
Empirical Formula: C18H11ClN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.381
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 89
Number of rings: 5

     

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