COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL523750
Chemical Name: (2E)-3-(2,4-dimethoxyphenyl)-N-[(4-methoxy-6-methyl-5-oxo-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]prop-2-enamide
Smiles: COc1ccc(c(c1)OC)/C=C/C(=O)NCc1c2OCOc2c(c2c1CCN(C2=O)C)OC

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Molecular Weight: 454.48
Empirical Formula: C24H26N2O7

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.034
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 95
Number of rings: 4

     

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