COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539910
Chemical Name: 3-{3-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-oxopropyl}-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-chromen-2-one
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CC[C@@]2([C@H](C1)CCCC2)O

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Molecular Weight: 439.55
Empirical Formula: C26H33NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.849
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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