COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586367
Chemical Name: (3aR,4R,4aR,7aS,8R,8aR)-3-[4-(benzyloxy)phenyl]-6-[3-(trifluoromethyl)phenyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@@H]2[C@H]1[C@H]1C[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)OCc1ccccc1

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Molecular Weight: 532.52
Empirical Formula: C30H23F3N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.439
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 7

     

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