COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL422215
Chemical Name: methyl4,6-dihydroxy-5-(3-methoxy-1-{2-[(4-methylphenyl)sulfonyl]pyridin-3-yl}-3-oxopropyl)pyridine-3-carboxylate
Smiles: COC(=O)CC(c1cccnc1S(=O)(=O)c1ccc(cc1)C)c1c(O)ncc(c1O)C(=O)OC

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Molecular Weight: 486.5
Empirical Formula: C23H22N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.216
Rotatable bonds: 10
H-donors: 2
H-acceptors: 8
PSA: 161
Number of rings: 3

     

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