COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK688331
Chemical Name: N-(1,3-benzodioxol-5-yl)-3-(4-nitro-1H-pyrazol-5-yl)-1H-1,2,4-triazol-5-amine
Smiles: [O-][N+](=O)c1cn[nH]c1c1n[nH]c(n1)Nc1ccc2c(c1)OCO2

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Saltdata: HCl
Molecular Weight: 315.25
Empirical Formula: C12H9N7O4

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 1.43
Rotatable bonds: 1
H-donors: 3
H-acceptors: 4
PSA: 146
Number of rings: 4

     

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