COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STL330770
Chemical Name: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)Cn1nc(c(c1C)Br)[N+](=O)[O-]

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Molecular Weight: 379.21
Empirical Formula: C15H15BrN4O3

Physical State: Dry powder
Available Amount: 182 mg

Lipinsky:
logP: 3.042
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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