COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK583345
Chemical Name: (1R,4aS,8aS)-2-(3-fluorobenzyl)-1-(4-hydroxy-3-methoxyphenyl)octahydroisoquinolin-4a(2H)-ol
Smiles: COc1cc(ccc1O)[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)Cc1cccc(c1)F

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Molecular Weight: 385.48
Empirical Formula: C23H28FNO3

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 3.016
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 52
Number of rings: 4

     

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