COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK856211
Chemical Name: methyl4-[1-(3,4-diethoxyphenyl)-6,7-diethoxy-3-oxo-3,4-dihydroisoquinolin-2(1H)-yl]benzoate
Smiles: CCOc1cc(ccc1OCC)C1N(c2ccc(cc2)C(=O)OC)C(=O)Cc2c1cc(OCC)c(c2)OCC

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Molecular Weight: 533.62
Empirical Formula: C31H35NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.991
Rotatable bonds: 10
H-donors: 0
H-acceptors: 7
PSA: 83
Number of rings: 4

     

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