COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK392826
Chemical Name: 3-{[5-(3,4-dimethyl-5-nitrophenyl)furan-2-yl]methylidene}-1,5-dioxaspiro[5.5]undecane-2,4-dione
Smiles: O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc(o1)c1cc(C)c(c(c1)[N+](=O)[O-])C

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Molecular Weight: 411.41
Empirical Formula: C22H21NO7

Physical State: Dry powder
Available Amount: 242 mg

Lipinsky:
logP: 3.77
Rotatable bonds: 2
H-donors: 0
H-acceptors: 7
PSA: 111
Number of rings: 4

     

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