COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL245843
Chemical Name: 2-hydroxy-3-{[4-(tetrahydro-2H-pyran-4-yl)piperazin-1-yl]methyl}-5-(thiomorpholin-4-ylmethyl)-4H-pyran-4-one
Smiles: Oc1occ(c(=O)c1CN1CCN(CC1)C1CCOCC1)CN1CCSCC1

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Molecular Weight: 409.55
Empirical Formula: C20H31N3O4S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 2.471
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 90
Number of rings: 4

     

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