COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL538610
Chemical Name: 4-{[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]carbonyl}-2-(2-methylpropyl)isoquinolin-1(2H)-one
Smiles: CC(Cn1cc(C(=O)N2CC[C@@]3([C@H](C2)CCCC3)O)c2c(c1=O)cccc2)C

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Molecular Weight: 382.5
Empirical Formula: C23H30N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.151
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 60
Number of rings: 4

     

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