COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512269
Chemical Name: N-(2,5-dimethylphenyl)-2-[4a-hydroxy-1-(3,4,5-trimethoxyphenyl)octahydroisoquinolin-2(1H)-yl]acetamide
Smiles: COc1cc(cc(c1OC)OC)C1N(CCC2(C1CCCC2)O)CC(=O)Nc1cc(C)ccc1C

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Molecular Weight: 482.62
Empirical Formula: C28H38N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.274
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 80
Number of rings: 4

     

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