COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL025172
Chemical Name: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]acetamide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C

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Molecular Weight: 448.48
Empirical Formula: C17H16N6O5S2

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: -0.083
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 171
Number of rings: 4

     

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