COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK847760
Chemical Name: 8-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-1,3-dimethyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2CCCc1ccccc1)CN1CCc2c(C1)cccc2

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Molecular Weight: 443.55
Empirical Formula: C26H29N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.824
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 5

     

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