COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143027
Chemical Name: (4E)-2-(4-nitrophenyl)-5-phenyl-4-[({2-[4-(phenylacetyl)piperazin-1-yl]ethyl}amino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C(N1CCN(CC1)CCN/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1)Cc1ccccc1

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Molecular Weight: 538.61
Empirical Formula: C30H30N6O4

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 3.085
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 5

     

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