COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552851
Chemical Name: (1S,9aS)-5-methyl-1-({[(2-oxo-6-pentyl-2H-pyran-3-yl)carbonyl]oxy}methyl)octahydro-2H-quinolizinium
Smiles: CCCCCc1ccc(c(=O)o1)C(=O)OC[C@H]1CCC[N+]2([C@H]1CCCC2)C

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Saltdata: I-
Molecular Weight: 376.52
Empirical Formula: C22H34NO4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.163
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 52
Number of rings: 3

     

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