COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809341
Chemical Name: methyl(2E)-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-3-oxobutanoate
Smiles: COC(=O)/C(=C/c1ccc(o1)c1ccccc1[N+](=O)[O-])/C(=O)C

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Molecular Weight: 315.28
Empirical Formula: C16H13NO6

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 2.636
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 102
Number of rings: 2

     

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