COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018717
Chemical Name: 8-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(CCNc2nc3c(n2C)c(=O)n(c(=O)n3C)C)ccc1OC

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Molecular Weight: 373.41
Empirical Formula: C18H23N5O4

Physical State: Dry powder
Available Amount: 349 mg

Lipinsky:
logP: 2.059
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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