COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388948
Chemical Name: 5-methylbenzene-1,3-diylbis(4-bromo-3-nitrobenzoate)
Smiles: Cc1cc(cc(c1)OC(=O)c1ccc(c(c1)[N+](=O)[O-])Br)OC(=O)c1ccc(c(c1)[N+](=O)[O-])Br

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Molecular Weight: 580.14
Empirical Formula: C21H12Br2N2O8

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 6.724
Rotatable bonds: 6
H-donors: 0
H-acceptors: 8
PSA: 144
Number of rings: 3

     

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