COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK682348
Chemical Name: 2-acetyl-3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-5-phenylcyclohex-2-en-1-one
Smiles: CCOc1cc(CCNC2=C(C(=O)C)C(=O)CC(C2)c2ccccc2)ccc1OCC

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Molecular Weight: 421.54
Empirical Formula: C26H31NO4

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 4.509
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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