COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL330480
Chemical Name: 1-(2-chlorobenzyl)-1-(4-hydroxy-4,4-diphenylbut-2-yn-1-yl)piperidinium
Smiles: Clc1ccccc1C[N+]1(CCCCC1)CC#CC(c1ccccc1)(c1ccccc1)O

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Saltdata: Cl-
Molecular Weight: 431
Empirical Formula: C28H29ClNO

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 3.82
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 20
Number of rings: 4

     

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