COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378178
Chemical Name: 5-{[5-(3,5-dimethyl-4-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-1,3-dioxane-4,6-dione
Smiles: O=C1OC(OC(=O)/C/1=C\c1ccc(o1)c1cc(C)c(c(c1)C)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 419.39
Empirical Formula: C23H17NO7

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 3.671
Rotatable bonds: 1
H-donors: 0
H-acceptors: 7
PSA: 111
Number of rings: 4

     

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