COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK630338
Chemical Name: 4-{[(1-benzylpiperidin-4-yl)ammonio]methyl}-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-olate
Smiles: [O-]c1ccc2c(c1C[NH2+]C1CCN(CC1)Cc1ccccc1)oc(=O)c1c2CCCC1

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Saltdata: 2 HCl
Molecular Weight: 418.54
Empirical Formula: C26H30N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.72
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 69
Number of rings: 5

     

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