COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574613
Chemical Name: (3aR,4R,4aR,7aS,8R,8aR)-3-(4-chlorophenyl)-6-[2-(3,4-dimethoxyphenyl)ethyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1ccc(cc1OC)CCN1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)Cl

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Molecular Weight: 480.95
Empirical Formula: C26H25ClN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.882
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 6

     

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