COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK439267
Chemical Name: (2E)-3-(4-tert-butylphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one
Smiles: O=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])/C=C/c1ccc(cc1)C(C)(C)C

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Molecular Weight: 393.49
Empirical Formula: C23H27N3O3

Physical State: Dry powder
Available Amount: 469 mg

Lipinsky:
logP: 5.076
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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