COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK279280
Chemical Name: 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)-2-nitrophenylacetate
Smiles: CC(=O)Oc1ccc(cc1[N+](=O)[O-])N1C(=O)C2C(C1=O)C1CCC2C=C1

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Molecular Weight: 356.33
Empirical Formula: C18H16N2O6

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 1.146
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 109
Number of rings: 5

     

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