COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057070
Chemical Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Smiles: COc1cc(cc(c1O)Br)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 585.32
Empirical Formula: C24H17BrN4O9

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.647
Rotatable bonds: 3
H-donors: 1
H-acceptors: 9
PSA: 170
Number of rings: 5

     

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