COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL336246
Chemical Name: ethyl1-{3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxylate
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCC(CC2)C(=O)OCC)/C1=O

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Molecular Weight: 528.7
Empirical Formula: C26H32N4O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.123
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 139
Number of rings: 4

     

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