COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK296323
Chemical Name: 2,2'-(benzene-1,4-diylbis{[(1E)-3-oxoprop-1-ene-1,3-diyl]benzene-4,1-diylcarbamoyl})bis(4-nitrobenzoicacid)
Smiles: O=C(c1ccc(cc1)NC(=O)c1cc(ccc1C(=O)O)[N+](=O)[O-])/C=C/c1ccc(cc1)/C=C/C(=O)c1ccc(cc1)NC(=O)c1cc(ccc1C(=O)O)[N+](=O)[O-]

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Molecular Weight: 754.67
Empirical Formula: C40H26N4O12

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 6.083
Rotatable bonds: 8
H-donors: 4
H-acceptors: 12
PSA: 258
Number of rings: 5

     

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