COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK720231
Chemical Name: 4-[(8-chloro-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)methyl]benzonitrile
Smiles: N#Cc1ccc(cc1)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 329.75
Empirical Formula: C15H12ClN5O2

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 2.529
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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