COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK785117
Chemical Name: 8-[(2-methoxyethyl)amino]-1,3-dimethyl-7-[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCNc1nc2c(n1CC(=O)C13CC4CC(C3)CC(C1)C4)c(=O)n(c(=O)n2C)C

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Molecular Weight: 429.52
Empirical Formula: C22H31N5O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.788
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 96
Number of rings: 6

     

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