COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681471
Chemical Name: N-[5,5-dimethyl-3-oxo-2-(phenylcarbonyl)cyclohex-1-en-1-yl]-beta-alanine
Smiles: OC(=O)CCNC1=C(C(=O)CC(C1)(C)C)C(=O)c1ccccc1

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Molecular Weight: 315.37
Empirical Formula: C18H21NO4

Available Amount: 0 mg

Lipinsky:
logP: 2.424
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 83
Number of rings: 2

     

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