COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741814
Chemical Name: (4E)-4-{[(2-hydroxyethyl)amino]methylidene}-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: OCCN/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 290.28
Empirical Formula: C13H14N4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.323
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 110
Number of rings: 2

     

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