COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL112735
Chemical Name: (4Z)-N-(2-chlorobenzyl)-N,N-diethyl-5-hydroxy-4-(hydroxyimino)-5,5-diphenylpentan-1-aminium
Smiles: O/N=C(\C(c1ccccc1)(c1ccccc1)O)/CCC[N+](Cc1ccccc1Cl)(CC)CC

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Saltdata: Cl-
Molecular Weight: 466.04
Empirical Formula: C28H34ClN2O2

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 1.265
Rotatable bonds: 11
H-donors: 2
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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