COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL294714
Chemical Name: 2-(4-ethoxyphenyl)-6-[(3-methoxypropyl)amino]-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: COCCCNc1c2cccc3c2c(cc1[N+](=O)[O-])c(=O)n(c3=O)c1ccc(cc1)OCC

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Molecular Weight: 449.46
Empirical Formula: C24H23N3O6

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 3.379
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 113
Number of rings: 4

     

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