COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK973007
Chemical Name: 2-[(2-ethoxy-5-nitrobenzyl)sulfanyl]-5-heptyl-6-methylpyrimidin-4-ol
Smiles: CCCCCCCc1c(C)nc(nc1O)SCc1cc(ccc1OCC)[N+](=O)[O-]

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Molecular Weight: 419.55
Empirical Formula: C21H29N3O4S

Available Amount: 0 mg

Lipinsky:
logP: 6.448
Rotatable bonds: 12
H-donors: 1
H-acceptors: 4
PSA: 126
Number of rings: 2

     

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