COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK591099
Chemical Name: (3aS,4R,4aS,7aR,8R,8aS)-3-(2,4-dichlorophenyl)-6-(4-methylphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@H]1O[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccc(cc1Cl)Cl

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Molecular Weight: 443.29
Empirical Formula: C22H16Cl2N2O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.257
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 6

     

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