COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555648
Chemical Name: (3aR,6aS)-3-(2,4-dichlorophenyl)-5-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: Clc1ccc(c(c1)Cl)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 406.18
Empirical Formula: C17H9Cl2N3O5

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.859
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 104
Number of rings: 4

     

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