COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206695
Chemical Name: (4E)-2-(4-nitrophenyl)-4-[({2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl}amino)methylidene]-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCCC1=NN(C(=O)/C/1=C/NCCN1CCN(CC1)C(=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 490.56
Empirical Formula: C26H30N6O4

Physical State: Dry powder
Available Amount: 175 mg

Lipinsky:
logP: 2.101
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 4

     

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