COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK833565
Chemical Name: 3-(8-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanenitrile
Smiles: N#CCCn1c(NCCc2ccc(c(c2)OC)OC)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 398.42
Empirical Formula: C19H22N6O4

Physical State: Dry powder
Available Amount: 253 mg

Lipinsky:
logP: 0.993
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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