COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK726712
Chemical Name: methyl3,5-dinitro-4-(4H-1,2,4-triazol-4-yl)benzoate
Smiles: COC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])n1cnnc1

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Molecular Weight: 293.2
Empirical Formula: C10H7N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.487
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 148
Number of rings: 2

     

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