COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK897070
Chemical Name: 2-(4-benzylpiperidin-1-yl)-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCC(CC2)Cc2ccccc2)/C1=O

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Molecular Weight: 534.7
Empirical Formula: C28H30N4O3S2

Physical State: Dry powder
Available Amount: 420 mg

Lipinsky:
logP: 2.706
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 122
Number of rings: 5

     

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