COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK594595
Chemical Name: (3aR,4R,4aR,7aS,8R,8aR)-6-tert-butyl-3-(2,4-dimethoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: COc1cc(OC)ccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)C(C)(C)C

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Molecular Weight: 398.46
Empirical Formula: C22H26N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.297
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 5

     

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