COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK776517
Chemical Name: 2-[(3,4-diethoxyphenyl)acetyl]-3-[(3-methoxyphenyl)amino]cyclohex-2-en-1-one
Smiles: CCOc1cc(ccc1OCC)CC(=O)C1=C(CCCC1=O)Nc1cccc(c1)OC

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Molecular Weight: 423.51
Empirical Formula: C25H29NO5

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 4.075
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 3

     

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