COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK805890
Chemical Name: methyl(5E)-5-{1-[(4-bromophenyl)amino]butylidene}-2,2-dimethyl-4,6-dioxocyclohexanecarboxylate
Smiles: CCC/C(=C\1/C(=O)CC(C(C1=O)C(=O)OC)(C)C)/Nc1ccc(cc1)Br

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Molecular Weight: 422.32
Empirical Formula: C20H24BrNO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.687
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 72
Number of rings: 2

     

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