COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL313918
Chemical Name: 6-(azepan-1-ylmethyl)-3-hydroxy-1-methyl-2-{[4-(pyrimidin-2-yl)piperazin-1-yl]methyl}pyridin-4(1H)-one
Smiles: Oc1c(=O)cc(n(c1CN1CCN(CC1)c1ncccn1)C)CN1CCCCCC1

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Molecular Weight: 412.54
Empirical Formula: C22H32N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.12
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 4

     

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