COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172388
Chemical Name: 2,2-dimethyl-1-{4-[3-(methylamino)-4-nitrophenyl]piperazin-1-yl}propan-1-one
Smiles: CNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)C(C)(C)C

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Molecular Weight: 320.39
Empirical Formula: C16H24N4O3

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 3.445
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 2

     

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