COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363663
Chemical Name: 2-bromo-4-{(E)-[5-(4-methylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}-6-nitrophenylacetate
Smiles: CC(=O)Oc1c(Br)cc(cc1[N+](=O)[O-])/C=C/1\C=C(OC1=O)c1ccc(cc1)C

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Molecular Weight: 444.24
Empirical Formula: C20H14BrNO6

Physical State: Dry powder
Available Amount: 175 mg

Lipinsky:
logP: 4.721
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 98
Number of rings: 3

     

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