COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK536825
Chemical Name: 8-bromo-1,3-dimethyl-7-[2-oxo-2-(thiophen-2-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1cccs1)Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 383.23
Empirical Formula: C13H11BrN4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.547
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 103
Number of rings: 3

     

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