COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK449487
Chemical Name: (5E)-3-ethyl-5-({5-[(pentachlorophenoxy)methyl]furan-2-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN1C(=S)S/C(=C/c2ccc(o2)COc2c(Cl)c(Cl)c(c(c2Cl)Cl)Cl)/C1=O

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Molecular Weight: 517.67
Empirical Formula: C17H10Cl5NO3S2

Physical State: Dry powder
Available Amount: 510 mg

Lipinsky:
logP: 6.426
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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