COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK332426
Chemical Name: cyclohexyl[7-nitro-1-(nitromethyl)-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Smiles: [O-][N+](=O)CC1N(CCc2c1cc(cc2)[N+](=O)[O-])C(=O)C1CCCCC1

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Molecular Weight: 347.37
Empirical Formula: C17H21N3O5

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 3.267
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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