COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK768019
Chemical Name: 1-(2-hydroxyethyl)-7,9-dimethyl-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: OCCN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)C)C12CC3CC(C2)CC(C1)C3

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Molecular Weight: 412.49
Empirical Formula: C21H28N6O3

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 1.934
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 7

     

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