COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK601280
Chemical Name: 5-(2-bromo-5-nitrophenyl)-6-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: OCC(n1cc2c(c1c1cc(ccc1Br)[N+](=O)[O-])c(=O)n(c(=O)n2C)C)(CO)CO

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Molecular Weight: 483.28
Empirical Formula: C18H19BrN4O7

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: 1.111
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 152
Number of rings: 3

     

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