COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565300
Chemical Name: (2E)-N-(4-methylphenyl)-2-(2,3,3-trimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanamide
Smiles: O=C(/C=C/1\c2ccccc2CC(N1C)(C)C)Nc1ccc(cc1)C

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Saltdata: HCl
Molecular Weight: 320.43
Empirical Formula: C21H24N2O

Physical State: Liquid
Available Amount: 99 mg

Lipinsky:
logP: 5.775
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 32
Number of rings: 3

     

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