COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK684460
Chemical Name: 3-amino-2-[(3,4-diethoxyphenyl)acetyl]cyclohex-2-en-1-one
Smiles: CCOc1cc(ccc1OCC)CC(=O)C1=C(N)CCCC1=O

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Molecular Weight: 317.38
Empirical Formula: C18H23NO4

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 2.046
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 78
Number of rings: 2

     

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