COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053260
Chemical Name: 7-[(2Z)-3-chlorobut-2-en-1-yl]-8-[(furan-2-ylmethyl)amino]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: C/C(=C/Cn1c(NCc2ccco2)nc2c1c(O)nc(=O)n2C)/Cl

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Molecular Weight: 349.78
Empirical Formula: C15H16ClN5O3

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 2.043
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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