COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681263
Chemical Name: 2-butanoyl-3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-5-phenylcyclohex-2-en-1-one
Smiles: CCCC(=O)C1=C(NCCc2ccc(c(c2)OCC)OCC)CC(CC1=O)c1ccccc1

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Molecular Weight: 449.59
Empirical Formula: C28H35NO4

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 5.572
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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