COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048059
Chemical Name: 2-{(Z)-[2-(4-ethylpiperazin-4-ium-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}phenolate
Smiles: CC[NH+]1CCN(CC1)C1=NC(=O)/C(=C/c2ccccc2[O-])/S1

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Molecular Weight: 317.41
Empirical Formula: C16H19N3O2S

Physical State: Dry powder
Available Amount: 296 mg

Lipinsky:
logP: 2.387
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 85
Number of rings: 3

     

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