COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL242020
Chemical Name: 2-hydroxy-3-[(4-phenylpiperazin-1-yl)methyl]-5-(thiomorpholin-4-ylmethyl)-4H-pyran-4-one
Smiles: Oc1occ(c(=O)c1CN1CCN(CC1)c1ccccc1)CN1CCSCC1

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Molecular Weight: 401.53
Empirical Formula: C21H27N3O3S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 3.002
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 4

     

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