COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112399
Chemical Name: bis[2-(3-nitrophenyl)-2-oxoethyl](3-nitrobenzylidene)propanedioate
Smiles: O=C(/C(=C/c1cccc(c1)[N+](=O)[O-])/C(=O)OCC(=O)c1cccc(c1)[N+](=O)[O-])OCC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 563.43
Empirical Formula: C26H17N3O12

Available Amount: 0 mg

Lipinsky:
logP: 5.09
Rotatable bonds: 11
H-donors: 0
H-acceptors: 12
PSA: 224
Number of rings: 3

     

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