COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK805884
Chemical Name: 7-[3-(1,3-benzoxazol-2-ylsulfanyl)propyl]-8-bromo-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCCSc1nc2c(o1)cccc2)Br

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Molecular Weight: 436.29
Empirical Formula: C16H14BrN5O3S

Available Amount: 0 mg

Lipinsky:
logP: 3.933
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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