COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539086
Chemical Name: [(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl][4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methanone
Smiles: COc1ccc(cc1)C1(CCOCC1)C(=O)N1CC[C@@]2([C@H](C1)CCCC2)O

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Molecular Weight: 373.49
Empirical Formula: C22H31NO4

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 2.626
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 59
Number of rings: 4

     

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