COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547751
Chemical Name: [(1R,4aS,8aS)-1-(2,5-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl](furan-2-yl)methanone
Smiles: COc1ccc(cc1[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)C(=O)c1ccco1)OC

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Molecular Weight: 385.46
Empirical Formula: C22H27NO5

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 3.063
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 4

     

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