COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL543666
Chemical Name: methyl3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-3-[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]propanoate
Smiles: COC(=O)CC(C1=C(O)C(=O)c2c(C1=O)cccc2)c1ccc(c(c1)OC)OCC(=O)OC

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Molecular Weight: 454.43
Empirical Formula: C24H22O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.201
Rotatable bonds: 11
H-donors: 1
H-acceptors: 9
PSA: 125
Number of rings: 3

     

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