COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK056949
Chemical Name: 3-(phenylamino)-1-(2,6,6-trimethylcyclohex-3-en-1-yl)butan-1-onehydrochloride
Smiles: CC(Nc1ccccc1)CC(=O)C1C(C)C=CCC1(C)C.Cl

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Molecular Weight: 321.89
Empirical Formula: C19H28ClNO

Physical State: Dry powder
Available Amount: 224 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 29
Number of rings: 2

     

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