COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK429000
Chemical Name: [6-bromo-2-(4-butylphenyl)quinolin-4-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Smiles: CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])Br

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Molecular Weight: 573.49
Empirical Formula: C30H29BrN4O3

Physical State: Dry powder
Available Amount: 1002 mg

Lipinsky:
logP: 6.799
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 82
Number of rings: 5

     

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