COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK677916
Chemical Name: 5-(4-chlorophenyl)-2-{[(3,4-dichlorobenzyl)amino]methylidene}cyclohexane-1,3-dione
Smiles: Clc1ccc(cc1)C1CC(=O)/C(=C/NCc2ccc(c(c2)Cl)Cl)/C(=O)C1

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Molecular Weight: 408.71
Empirical Formula: C20H16Cl3NO2

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 4.539
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 46
Number of rings: 3

     

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