COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672485
Chemical Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-(methylsulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-amine
Smiles: CSc1nnc2n1ncn2/N=C/c1cc2OCOc2cc1Br

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Molecular Weight: 381.21
Empirical Formula: C12H9BrN6O2S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 3.091
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 104
Number of rings: 4

     

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