COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK082489
Chemical Name: 8-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-1,3-dimethyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccccc1Cn1c(SC2=NCCS2)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 401.51
Empirical Formula: C18H19N5O2S2

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 3.233
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 121
Number of rings: 4

     

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