COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL314779
Chemical Name: 3-(azepan-1-ylmethyl)-2-hydroxy-5-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1coc(c(c1=O)CN1CCCCCC1)O

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Molecular Weight: 427.54
Empirical Formula: C24H33N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.971
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 65
Number of rings: 4

     

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