COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527424
Chemical Name: 7-ethyl-8-{4-[2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]piperazin-1-yl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)[nH]c(=O)n3C)c(n2C)C

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Molecular Weight: 493.57
Empirical Formula: C25H31N7O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.632
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 5

     

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