COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK695941
Chemical Name: 2-(3,3,5-trimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)cyclohexane-1,3-dione
Smiles: O=C1CCCC(=O)C1=C1NC(C)(C)Cc2c1cccc2C

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Molecular Weight: 283.37
Empirical Formula: C18H21NO2

Physical State: Dry powder
Available Amount: 28 mg

Lipinsky:
logP: 1.956
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 46
Number of rings: 3

     

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