COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL543268
Chemical Name: methyl4,6-dihydroxy-5-[1-(4-hydroxy-3,5-dimethoxyphenyl)-3-methoxy-3-oxopropyl]pyridine-3-carboxylate
Smiles: COC(=O)CC(c1c(O)ncc(c1O)C(=O)OC)c1cc(OC)c(c(c1)OC)O

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Molecular Weight: 407.38
Empirical Formula: C19H21NO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -1.222
Rotatable bonds: 11
H-donors: 3
H-acceptors: 9
PSA: 144
Number of rings: 2

     

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