COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK026765
Chemical Name: 1-{(1E)-3-(azepan-1-yl)-3-oxo-1-[4-(propan-2-yl)phenyl]prop-1-en-2-yl}pyridin-2(1H)-one
Smiles: O=C(/C(=C\c1ccc(cc1)C(C)C)/n1ccccc1=O)N1CCCCCC1

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Molecular Weight: 364.49
Empirical Formula: C23H28N2O2

Physical State: Dry powder
Available Amount: 279 mg

Lipinsky:
logP: 4.18
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 40
Number of rings: 3

     

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