COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056771
Chemical Name: 2-[(Z)-{2-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenylbenzenesulfonate
Smiles: O=C1N=C(S/C/1=C\c1ccccc1OS(=O)(=O)c1ccccc1)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 550.62
Empirical Formula: C26H22N4O6S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.441
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 158
Number of rings: 5

     

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