COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL319167
Chemical Name: 2-hydroxy-3-{[4-(2-phenoxyethyl)piperazin-1-yl]methyl}-5-(thiomorpholin-4-ylmethyl)-4H-pyran-4-one
Smiles: Oc1occ(c(=O)c1CN1CCN(CC1)CCOc1ccccc1)CN1CCSCC1

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Molecular Weight: 445.58
Empirical Formula: C23H31N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.437
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 90
Number of rings: 4

     

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