COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150046
Chemical Name: 3-[(2,2-dimethoxyethyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Smiles: COC(CNC1=CC(=O)CC(C1)(C)C)OC

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Molecular Weight: 227.3
Empirical Formula: C12H21NO3

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 1.726
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 1

     

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