COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380799
Chemical Name: 3-{(2Z)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-5-ethyl-4H-1,2,4-triazol-4-amine
Smiles: CCc1nnc(n1N)N/N=C\c1cc2OCOc2cc1Br

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Saltdata: HCl
Molecular Weight: 353.18
Empirical Formula: C12H13BrN6O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.981
Rotatable bonds: 3
H-donors: 3
H-acceptors: 2
PSA: 99
Number of rings: 3

     

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