COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555130
Chemical Name: (3aR,6aS)-5-(2-methyl-4-nitrophenyl)-3-(3-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: Cc1cc(ccc1N1C(=O)[C@H]2[C@@H](C1=O)ON=C2c1cccc(c1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 396.32
Empirical Formula: C18H12N4O7

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 1.847
Rotatable bonds: 1
H-donors: 0
H-acceptors: 7
PSA: 150
Number of rings: 4

     

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