COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK728241
Chemical Name: 2-(2H-benzotriazol-2-yl)-4-methylphenyl2-methyl-3,5-dinitrobenzoate
Smiles: Cc1ccc(c(c1)n1nc2c(n1)cccc2)OC(=O)c1cc(cc(c1C)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 433.38
Empirical Formula: C21H15N5O6

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 6.128
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 148
Number of rings: 4

     

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