COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK724592
Chemical Name: (4a,6a-dimethyltetrahydro-2H-1,4-dioxa-6b-azacyclopenta[cd]pentalen-2a(3H)-yl)methyl4-nitrobenzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCC12COC3(N2C(OC1)(C)CC3)C

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Molecular Weight: 348.36
Empirical Formula: C17H20N2O6

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 3.129
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 93
Number of rings: 4

     

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