COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL355186
Chemical Name: N-(2-chlorobenzyl)-5-cyclohexyl-N,N-diethyl-5-hydroxy-5-phenylpent-3-yn-1-aminium
Smiles: CC[N+](Cc1ccccc1Cl)(CCC#CC(c1ccccc1)(C1CCCCC1)O)CC

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Saltdata: CI-
Molecular Weight: 439.06
Empirical Formula: C28H37ClNO

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 2.07
Rotatable bonds: 8
H-donors: 1
H-acceptors: 1
PSA: 20
Number of rings: 3

     

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