COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL222560
Chemical Name: benzyl5-(3-nitrophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)C2C1C(=NN2)C(=O)OCc1ccccc1

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Molecular Weight: 394.34
Empirical Formula: C19H14N4O6

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 0.839
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 133
Number of rings: 4

     

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