COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL327758
Chemical Name: 1-(2-chlorobenzyl)-1-(4-cyclohexyl-4-hydroxy-4-phenylbut-2-yn-1-yl)piperidinium
Smiles: Clc1ccccc1C[N+]1(CCCCC1)CC#CC(c1ccccc1)(C1CCCCC1)O

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Saltdata: Cl-
Molecular Weight: 437.04
Empirical Formula: C28H35ClNO

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 4.21
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 20
Number of rings: 4

     

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