COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL231838
Chemical Name: methyl2-[({1-[4-(diethylamino)phenyl]-4a-hydroxyoctahydroisoquinolin-2(1H)-yl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: CCN(c1ccc(cc1)C1N(CCC2(C1CCCC2)O)CC(=O)Nc1sc(c(c1C(=O)OC)C)C)CC

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Molecular Weight: 527.73
Empirical Formula: C29H41N3O4S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 6.557
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 110
Number of rings: 4

     

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