COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK573903
Chemical Name: (1R,4aS,8aS)-2-(2-fluorobenzyl)-1-(3,4,5-trimethoxyphenyl)octahydroisoquinolin-4a(2H)-ol
Smiles: COc1cc(cc(c1OC)OC)[C@@H]1N(CC[C@@]2([C@H]1CCCC2)O)Cc1ccccc1F

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Molecular Weight: 429.53
Empirical Formula: C25H32FNO4

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 3.487
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 51
Number of rings: 4

     

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