COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588218
Chemical Name: [(3aR,4R,4aR,7aS,8R,8aR)-3-(3-nitrophenyl)-5,7-dioxo-3a,4,4a,5,7,7a,8,8a-octahydro-6H-4,8-methano[1,2]oxazolo[4,5-f]isoindol-6-yl]aceticacid
Smiles: OC(=O)CN1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 385.33
Empirical Formula: C18H15N3O7

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.725
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 142
Number of rings: 5

     

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