COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK955571
Chemical Name: 1-{2-[(3,6-dihydro-2H-pyran-4-ylmethyl)(3-methylphenyl)amino]-2-oxoethyl}pyridinium
Smiles: Cc1cccc(c1)N(C(=O)C[n+]1ccccc1)CC1=CCOCC1

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Saltdata: Cl-
Molecular Weight: 323.41
Empirical Formula: C20H23N2O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -1.756
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 33
Number of rings: 3

     

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