COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150461
Chemical Name: (E)-(4-fluorophenyl)[2-(2-fluorophenyl)-4,5-dioxo-1-(pyrimidin-1-ium-2-yl)pyrrolidin-3-ylidene]methanolate
Smiles: Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)c1nccc[nH+]1)/[O-]

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Molecular Weight: 393.35
Empirical Formula: C21H13F2N3O3

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 2.983
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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