COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363434
Chemical Name: 2-(4-benzylpiperidin-1-yl)-7-methyl-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCC(CC2)Cc2ccccc2)/C1=O

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Molecular Weight: 546.76
Empirical Formula: C30H34N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.195
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 113
Number of rings: 5

     

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