COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL156182
Chemical Name: 2-(4-{[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: OCc1oc(CN2CCN(CC2)c2nc3CCCCc3cc2C#N)c(c(=O)c1)O

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Molecular Weight: 396.45
Empirical Formula: C21H24N4O4

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.683
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 109
Number of rings: 4

     

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