COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK340939
Chemical Name: methyl2-{[4-(3-nitro-1H-1,2,4-triazol-1-yl)butanoyl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CCCn1cnc(n1)[N+](=O)[O-]

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Molecular Weight: 333.3
Empirical Formula: C14H15N5O5

Available Amount: 0 mg

Lipinsky:
logP: 1.237
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 2

     

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