COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK669774
Chemical Name: (4Z)-2-(1,3-benzodioxol-5-yl)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)OCO2

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Molecular Weight: 404.34
Empirical Formula: C21H12N2O7

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 4.683
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 116
Number of rings: 5

     

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