COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545011
Chemical Name: methyl(3-oxo-1-{4-oxo-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-2-yl}piperazin-2-yl)acetate
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCNC(=O)C2CC(=O)OC)/C1=O

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Molecular Weight: 529.64
Empirical Formula: C24H27N5O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.628
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 169
Number of rings: 4

     

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