COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK508993
Chemical Name: 4-{[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylidene]amino}-5-phenyl-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1/N=C/c1cc2OCOc2cc1Cl)c1ccccc1

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Molecular Weight: 358.81
Empirical Formula: C16H11ClN4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.064
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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