COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL543119
Chemical Name: methyl3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-3-[3-(hydroxymethyl)-4-methoxyphenyl]propanoate
Smiles: COC(=O)CC(C1=C(O)C(=O)c2c(C1=O)cccc2)c1ccc(c(c1)CO)OC

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Molecular Weight: 396.4
Empirical Formula: C22H20O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.92
Rotatable bonds: 9
H-donors: 2
H-acceptors: 7
PSA: 110
Number of rings: 3

     

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