COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085028
Chemical Name: 5-(4-chlorophenyl)-3-[(3,4-dichlorobenzyl)amino]cyclohex-2-en-1-one
Smiles: O=C1C=C(NCc2ccc(c(c2)Cl)Cl)CC(C1)c1ccc(cc1)Cl

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Molecular Weight: 380.7
Empirical Formula: C19H16Cl3NO

Physical State: Dry powder
Available Amount: 381 mg

Lipinsky:
logP: 5.359
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 29
Number of rings: 3

     

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