COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK372055
Chemical Name: (2,4-dinitrophenyl){4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methanone
Smiles: O=C(c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])N1CCN(CC1)C/C=C/c1ccccc1

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Molecular Weight: 396.4
Empirical Formula: C20H20N4O5

Physical State: Dry powder
Available Amount: 905 mg

Lipinsky:
logP: 1.972
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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