COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL482864
Chemical Name: 2-{[(3,4-dichlorobenzyl)amino]methylidene}-5-phenylcyclohexane-1,3-dione
Smiles: O=C1CC(CC(=O)/C/1=C\NCc1ccc(c(c1)Cl)Cl)c1ccccc1

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Molecular Weight: 374.27
Empirical Formula: C20H17Cl2NO2

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 3.944
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 46
Number of rings: 3

     

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