COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053353
Chemical Name: 3-[(Z)-{2-[4-(4-fluorophenyl)piperazin-4-ium-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenolate
Smiles: Fc1ccc(cc1)[NH+]1CCN(CC1)C1=NC(=O)/C(=C/c2cccc(c2)[O-])/S1

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Molecular Weight: 383.45
Empirical Formula: C20H18FN3O2S

Physical State: Dry powder
Available Amount: 318 mg

Lipinsky:
logP: 2.65
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 85
Number of rings: 4

     

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