COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL025358
Chemical Name: 2-(4-benzylpiperazin-1-yl)-9-methyl-3-{(Z)-[3-(3-methylbutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)Cc2ccccc2)/C1=O)C

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Molecular Weight: 547.75
Empirical Formula: C29H33N5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.784
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 5

     

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