COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809204
Chemical Name: 4-[(E)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl4-chlorobenzoate
Smiles: CCCCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OC(=O)c2ccc(cc2)Cl)/C1=O

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Molecular Weight: 461.99
Empirical Formula: C22H20ClNO4S2

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 5.586
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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