COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039373
Chemical Name: 8-[(dibenzylamino)methyl]-7-(2,3-dihydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCC(Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C)O

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Molecular Weight: 463.54
Empirical Formula: C25H29N5O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.227
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 102
Number of rings: 4

     

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