COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559900
Chemical Name: (E)-[2-(3-nitrophenyl)-4,5-dioxo-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene](phenyl)methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1nccc[nH+]1)/c1ccccc1

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Molecular Weight: 402.37
Empirical Formula: C21H14N4O5

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 2.653
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 4

     

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