COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK849463
Chemical Name: 7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-8-(dimethylamino)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(c1nc2c(n1CCSc1nc3c(s1)cccc3)c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 416.53
Empirical Formula: C18H20N6O2S2

Physical State: Dry powder
Available Amount: 299 mg

Lipinsky:
logP: 3.284
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 128
Number of rings: 4

     

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