COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007614
Chemical Name: 7-[3-(1,3-benzothiazol-2-ylsulfanyl)propyl]-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCCSc1nc2c(s1)cccc2)N1CCCCC1

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Molecular Weight: 456.59
Empirical Formula: C21H24N6O2S2

Available Amount: 0 mg

Lipinsky:
logP: 3.559
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 136
Number of rings: 5

     

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