COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333037
Chemical Name: methyl1-ethyl-2-methyl-1H-benzimidazole-5-carboxylate-2,4,6-trinitrophenol(1:1)
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])O.COC(=O)c1ccc2c(c1)nc(n2CC)C

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Molecular Weight: 447.36
Empirical Formula: C18H17N5O9

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 1
H-acceptors: 9
PSA: 201
Number of rings: 3

     

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