COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK848757
Chemical Name: 4-[(1,3-benzodioxol-5-ylmethyl)amino]-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: [O-][N+](=O)c1c(NCc2ccc3c(c2)OCO3)c2ccccc2n(c1=O)C

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Molecular Weight: 353.33
Empirical Formula: C18H15N3O5

Physical State: Dry powder
Available Amount: 248 mg

Lipinsky:
logP: 1.841
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 4

     

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