COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL313408
Chemical Name: 2-hydroxy-5-(thiomorpholin-4-ylmethyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methyl]-4H-pyran-4-one
Smiles: Oc1occ(c(=O)c1CN1CC2(CC1CC(C2)(C)C)C)CN1CCSCC1

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Molecular Weight: 392.56
Empirical Formula: C21H32N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.406
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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