COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL260863
Chemical Name: methyl3-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-5-nitrobenzoate
Smiles: COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 358.31
Empirical Formula: C17H14N2O7

Physical State: Dry powder
Available Amount: 532 mg

Lipinsky:
logP: 2.865
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 119
Number of rings: 3

     

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