COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057022
Chemical Name: 6-hydroxy-7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one
Smiles: OCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(O)nc(=O)n2C

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Molecular Weight: 373.33
Empirical Formula: C15H15N7O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.452
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 161
Number of rings: 3

     

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