COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL308988
Chemical Name: 6-(azepan-1-ylmethyl)-3-hydroxy-1-methyl-2-{[4-(tetrahydro-2H-pyran-4-yl)piperazin-1-yl]methyl}pyridin-4(1H)-one
Smiles: O=c1cc(CN2CCCCCC2)n(c(c1O)CN1CCN(CC1)C1CCOCC1)C

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Molecular Weight: 418.58
Empirical Formula: C23H38N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.401
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 59
Number of rings: 4

     

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