COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444502
Chemical Name: 3,4-dihydroquinolin-1(2H)-yl(4-methyl-3,5-dinitrophenyl)methanone
Smiles: O=C(N1CCCc2c1cccc2)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C

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Molecular Weight: 341.32
Empirical Formula: C17H15N3O5

Physical State: Dry powder
Available Amount: 1434 mg

Lipinsky:
logP: 3.337
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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