COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL184269
Chemical Name: 3,4-dihydroisoquinolin-2(1H)-yl[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone
Smiles: O=C(c1cn[nH]c1c1ccc(cc1)[N+](=O)[O-])N1CCc2c(C1)cccc2

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Molecular Weight: 348.36
Empirical Formula: C19H16N4O3

Physical State: Dry powder
Available Amount: 17 mg

Lipinsky:
logP: 2.066
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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