COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396265
Chemical Name: 3-[(2E)-2-[3-(4-methoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]quinolin-1(2H)-yl]propane-1-sulfonicacid
Smiles: COc1ccc(cc1)N1C(=S)S/C(=c/2\ccc3c(n2CCCS(=O)(=O)O)cccc3)/C1=O

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Saltdata: (C2H5)3N
Molecular Weight: 488.61
Empirical Formula: C22H20N2O5S3

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 2.071
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 152
Number of rings: 4

     

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