COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL094863
Chemical Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-8-nitro-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Smiles: O=C1NC2CC(N1c1ccc3c(c1)OCCO3)(C)Oc1c2cc(cc1)[N+](=O)[O-]

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Molecular Weight: 383.36
Empirical Formula: C19H17N3O6

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 2.656
Rotatable bonds: 0
H-donors: 1
H-acceptors: 6
PSA: 105
Number of rings: 5

     

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