COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL330498
Chemical Name: 1,2-bis{4-[(4-nitrophenyl)ethynyl]phenyl}ethane-1,2-dione
Smiles: O=C(C(=O)c1ccc(cc1)C#Cc1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)C#Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 500.47
Empirical Formula: C30H16N2O6

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 7.963
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 125
Number of rings: 4

     

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