COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK409776
Chemical Name: methyl2-({[1-(2-ethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOc1ccccc1C1N(CCC2(C1CCCC2)O)CC(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 526.7
Empirical Formula: C29H38N2O5S

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 6.598
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 116
Number of rings: 5

     

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