COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK864538
Chemical Name: 2-{(E)-[2-(4-acetylpiperazin-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}phenylbenzenesulfonate
Smiles: CC(=O)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OS(=O)(=O)c2ccccc2)/S1

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Molecular Weight: 471.56
Empirical Formula: C22H21N3O5S2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.087
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 130
Number of rings: 4

     

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