COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552109
Chemical Name: 4-[(E)-{2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenylbenzenesulfonate
Smiles: O=C1N=C(S/C/1=C/c1ccc(cc1)OS(=O)(=O)c1ccccc1)N1CCN(CC1)c1ccc(c(c1)Cl)C

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Molecular Weight: 554.09
Empirical Formula: C27H24ClN3O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.406
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 112
Number of rings: 5

     

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