COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL175145
Chemical Name: [4a-hydroxy-1-(3,4,5-trimethoxyphenyl)octahydroisoquinolin-2(1H)-yl](phenyl)methanone
Smiles: COc1cc(cc(c1OC)OC)C1N(CCC2(C1CCCC2)O)C(=O)c1ccccc1

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Molecular Weight: 425.52
Empirical Formula: C25H31NO5

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 2.65
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 68
Number of rings: 4

     

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