COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527023
Chemical Name: 8-[(1E)-3-(3-chlorophenyl)triaz-1-en-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cccc(c1)N/N=N/c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

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Molecular Weight: 333.74
Empirical Formula: C13H12ClN7O2

Physical State: Dry powder
Available Amount: 694 mg

Lipinsky:
logP: 3.606
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 106
Number of rings: 3

     

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