COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683903
Chemical Name: 2-[(3,4-diethoxyphenyl)acetyl]-3-[(2-hydroxyethyl)amino]cyclohex-2-en-1-one
Smiles: OCCNC1=C(C(=O)Cc2ccc(c(c2)OCC)OCC)C(=O)CCC1

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Molecular Weight: 361.44
Empirical Formula: C20H27NO5

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 2.195
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 2

     

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