COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK583728
Chemical Name: (3aR,4R,4aR,7aS,8R,8aR)-3-[4-(benzyloxy)phenyl]-6-[2-(dimethylamino)ethyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: CN(CCN1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccc(cc1)OCc1ccccc1)C

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Molecular Weight: 459.55
Empirical Formula: C27H29N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.083
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 71
Number of rings: 6

     

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