COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049264
Chemical Name: 6-hydroxy-7-(2-hydroxyethyl)-3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-3,7-dihydro-2H-purin-2-one
Smiles: OCCn1c(N/N=C(/c2ccc(cc2)[N+](=O)[O-])\C)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 387.36
Empirical Formula: C16H17N7O5

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 0.361
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 161
Number of rings: 3

     

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