COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL538725
Chemical Name: 2-{(2S)-1-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-1-oxopropan-2-yl}-2,3-dihydro-1H-isoindol-1-one
Smiles: O=C([C@@H](N1Cc2c(C1=O)cccc2)C)N1CC[C@@]2([C@H](C1)CCCC2)O

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Molecular Weight: 342.44
Empirical Formula: C20H26N2O3

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 1.292
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 60
Number of rings: 4

     

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