COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551526
Chemical Name: N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-3-(6-hydroxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)C(c1cc2OCOc2cc1O)CC(=O)NCC(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 488.54
Empirical Formula: C28H28N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.818
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 97
Number of rings: 5

     

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