COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547506
Chemical Name: 1-[(1R,4aS,8aS)-4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]ethanone
Smiles: COc1ccccc1[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)C(=O)C

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Molecular Weight: 303.4
Empirical Formula: C18H25NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.346
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 49
Number of rings: 3

     

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