COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK853851
Chemical Name: methyl{7-[(2E)-but-2-en-1-yl]-3,9-dimethyl-6,8-dioxo-6,7,8,9-tetrahydro[1,2,4]triazino[3,4-f]purin-1(4H)-yl}acetate
Smiles: C/C=C/Cn1c(=O)n(C)c2c(c1=O)n1CC(=NN(c1n2)CC(=O)OC)C

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Molecular Weight: 360.37
Empirical Formula: C16H20N6O4

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 1.13
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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