COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK813969
Chemical Name: (5Z)-5-(2H-chromen-3-ylmethylidene)-3-(2-ethylhexyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCC(CN1C(=S)S/C(=C\C2=Cc3c(OC2)cccc3)/C1=O)CC

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Molecular Weight: 387.57
Empirical Formula: C21H25NO2S2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 5.442
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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