COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL318452
Chemical Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(1H-imidazol-5-yl)ethyl]-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Smiles: O=C(C1c2ccccc2C(=O)N(C1c1ccc2c(c1)OCO2)C)NCCc1[nH]cnc1

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Molecular Weight: 418.45
Empirical Formula: C23H22N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.553
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 96
Number of rings: 5

     

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