COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK770965
Chemical Name: 5,5-dimethyl-3-[(1,2,3,4-tetrahydroisoquinolin-1-ylmethyl)amino]cyclohex-2-en-1-one
Smiles: O=C1C=C(NCC2NCCc3c2cccc3)CC(C1)(C)C

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Molecular Weight: 284.4
Empirical Formula: C18H24N2O

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 2.473
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 41
Number of rings: 3

     

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