COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL267498
Chemical Name: 4-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-5-(4-bromophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Brc1ccc(cc1)c1nnc(n1/N=C/c1ccc2c(c1)OCO2)S

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Molecular Weight: 403.26
Empirical Formula: C16H11BrN4O2S

Available Amount: 0 mg

Lipinsky:
logP: 5.182
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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