COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396264
Chemical Name: 3-[(2E)-2-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)quinolin-1(2H)-yl]propane-1-sulfonicacid
Smiles: CN1C(=S)S/C(=c/2\ccc3c(n2CCCS(=O)(=O)O)cccc3)/C1=O

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Saltdata: (C2H5)3N
Molecular Weight: 396.51
Empirical Formula: C16H16N2O4S3

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: -0.432
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 143
Number of rings: 3

     

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