COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL178871
Chemical Name: (2,4-dimethoxyphenyl)[4a-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]methanone
Smiles: COc1ccc(c(c1)OC)C(=O)N1CCC2(C(C1c1ccc(c(c1)OC)O)CCCC2)O

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Molecular Weight: 441.52
Empirical Formula: C25H31NO6

Physical State: Dry powder
Available Amount: 22 mg

Lipinsky:
logP: 2.86
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 88
Number of rings: 4

     

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