COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL309043
Chemical Name: 5-[2-(azepan-1-yl)-2-oxoethoxy]-2-[(4-phenylpiperazin-1-yl)methyl]-4H-pyran-4-one
Smiles: O=C(N1CCCCCC1)COc1coc(cc1=O)CN1CCN(CC1)c1ccccc1

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Molecular Weight: 425.53
Empirical Formula: C24H31N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.339
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 62
Number of rings: 4

     

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