COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005970
Chemical Name: 7-[(2E)-3-chlorobut-2-en-1-yl]-8-[(furan-2-ylmethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=C\Cn1c(NCc2ccco2)nc2c1c(=O)[nH]c(=O)n2C)/Cl

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Molecular Weight: 349.78
Empirical Formula: C15H16ClN5O3

Available Amount: 0 mg

Lipinsky:
logP: 2.393
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 92
Number of rings: 3

     

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