COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL178868
Chemical Name: [4a-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-2(1H)-yl](2-methoxyphenyl)methanone
Smiles: COc1cc(ccc1O)C1N(CCC2(C1CCCC2)O)C(=O)c1ccccc1OC

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Molecular Weight: 411.5
Empirical Formula: C24H29NO5

Physical State: Dry powder
Available Amount: 43 mg

Lipinsky:
logP: 2.454
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 79
Number of rings: 4

     

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