COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035307
Chemical Name: (5Z)-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)CCC(=O)N2CCN(CC2)C)cc(c1OC)OC

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Molecular Weight: 465.59
Empirical Formula: C21H27N3O5S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.167
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 128
Number of rings: 3

     

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