COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048273
Chemical Name: 1'-ethyl-2'-methyl-6'-nitro-2,6-dioxo-1,1',4',6-tetrahydro-2H,2'H-spiro[pyrimidine-5,3'-quinolinium]-4-olate
Smiles: CC[NH+]1c2ccc(cc2CC2(C1C)C(=O)NC(=O)N=C2[O-])[N+](=O)[O-]

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Molecular Weight: 332.32
Empirical Formula: C15H16N4O5

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 2.04
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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