COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL471748
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-oxo-2-(propan-2-yl)-1,2-dihydroisoquinoline-4-carboxamide
Smiles: COc1cc(CCNC(=O)c2cn(C(C)C)c(=O)c3c2cccc3)ccc1OC

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Molecular Weight: 394.47
Empirical Formula: C23H26N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.046
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 3

     

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