COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605539
Chemical Name: 5-(2-bromo-5-nitrophenyl)-6-(3-hydroxypropyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: OCCCn1cc2c(c1c1cc(ccc1Br)[N+](=O)[O-])c(=O)n(c(=O)n2C)C

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Molecular Weight: 437.25
Empirical Formula: C17H17BrN4O5

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 1.728
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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