COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547967
Chemical Name: methyl(1R,4aS,8aS)-1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinoline-2(1H)-carboxylate
Smiles: COc1ccc(c(c1)[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)C(=O)OC)OC

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Molecular Weight: 349.43
Empirical Formula: C19H27NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.484
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 68
Number of rings: 3

     

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