COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL239626
Chemical Name: 6-(2-amino-5-nitrophenyl)-5-(4-fluorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Fc1ccc(cc1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1cc(ccc1N)[N+](=O)[O-]

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Molecular Weight: 409.38
Empirical Formula: C20H16FN5O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.281
Rotatable bonds: 0
H-donors: 2
H-acceptors: 4
PSA: 117
Number of rings: 4

     

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