COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526702
Chemical Name: (1aR,2S,5aR,6aR,9S,9aR,9bS)-9-(((S)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-2,5a-dimethyloctahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-one
Smiles: COc1cc2c(cc1OC)CCN([C@H]2C)CC1C(=O)O[C@H]2[C@@H]1[C@@H]1O[C@@]31[C@](C2)(C)CCC[C@@H]3C

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Molecular Weight: 455.59
Empirical Formula: C27H37NO5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.763
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 60
Number of rings: 6

     

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