COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035352
Chemical Name: (5E)-3-[4-(3,4-dihydroquinolin-1(2H)-yl)-4-oxobutyl]-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cccs2)/C(=O)N1CCCC(=O)N1CCCc2c1cccc2

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Molecular Weight: 428.6
Empirical Formula: C21H20N2O2S3

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 4.265
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 126
Number of rings: 4

     

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