COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL006528
Chemical Name: 3-[(2E)-2-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3(2H)-yl]propane-1-sulfonate
Smiles: CCN1C(=S)S/C(=c\2/sc3c(n2CCCS(=O)(=O)[O-])cccc3)/C1=O

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Saltdata: (C2H5)3NH+
Molecular Weight: 415.56
Empirical Formula: C15H15N2O4S4

Available Amount: 0 mg

Lipinsky:
logP: -1.201
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 171
Number of rings: 3

     

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