COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK630584
Chemical Name: methyl4-[(E)-{3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CC(=O)N1CCN(CC1)C

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Molecular Weight: 419.53
Empirical Formula: C19H21N3O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.556
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 127
Number of rings: 3

     

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