COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850456
Chemical Name: 7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-1,3-dimethyl-8-(methylamino)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CNc1nc2c(n1CCSc1nc3c(s1)cccc3)c(=O)n(c(=O)n2C)C

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Molecular Weight: 402.5
Empirical Formula: C17H18N6O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.321
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 136
Number of rings: 4

     

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