COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040495
Chemical Name: 2-methyl-4,6-dinitro-3-(phenylcarbonyl)-1-benzofuran-5-ylacetate
Smiles: CC(=O)Oc1c(cc2c(c1[N+](=O)[O-])c(c(o2)C)C(=O)c1ccccc1)[N+](=O)[O-]

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Molecular Weight: 384.3
Empirical Formula: C18H12N2O8

Physical State: Dry powder
Available Amount: 322 mg

Lipinsky:
logP: 3.356
Rotatable bonds: 3
H-donors: 0
H-acceptors: 8
PSA: 148
Number of rings: 3

     

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