COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388920
Chemical Name: benzene-1,4-diylbis(2-methyl-3,5-dinitrobenzoate)
Smiles: [O-][N+](=O)c1cc(C(=O)Oc2ccc(cc2)OC(=O)c2cc(cc(c2C)[N+](=O)[O-])[N+](=O)[O-])c(c(c1)[N+](=O)[O-])C

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Molecular Weight: 526.37
Empirical Formula: C22H14N4O12

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 5.488
Rotatable bonds: 4
H-donors: 0
H-acceptors: 12
PSA: 235
Number of rings: 3

     

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