COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811060
Chemical Name: 3-[(5Z)-5-{[2-(4-benzylpiperidin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: OC(=O)CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCC(CC2)Cc2ccccc2)/C1=O

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Molecular Weight: 548.69
Empirical Formula: C28H28N4O4S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 2.876
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 150
Number of rings: 5

     

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