COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL094865
Chemical Name: ethyl4-(2-methyl-8-nitro-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)NC2CC1(C)Oc1c2cc(cc1)[N+](=O)[O-]

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Molecular Weight: 397.39
Empirical Formula: C20H19N3O6

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 3.5
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 113
Number of rings: 4

     

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