COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL313460
Chemical Name: 3-(azepan-1-ylmethyl)-2-hydroxy-5-[(4-phenylpiperazin-1-yl)methyl]-4H-pyran-4-one
Smiles: Oc1occ(c(=O)c1CN1CCCCCC1)CN1CCN(CC1)c1ccccc1

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Molecular Weight: 397.52
Empirical Formula: C23H31N3O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 4.166
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 56
Number of rings: 4

     

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