COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL435214
Chemical Name: ethyl5-[1-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-3-{[2-(4-hydroxyphenyl)ethyl]amino}-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1cc(OC)c2c(c1OC)OCO2)CC(=O)NCCc1ccc(cc1)O

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Molecular Weight: 554.55
Empirical Formula: C28H30N2O10

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.792
Rotatable bonds: 13
H-donors: 4
H-acceptors: 10
PSA: 161
Number of rings: 4

     

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