COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143033
Chemical Name: (4Z)-4-(aminomethylidene)-2-(4-nitrophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCCC1=NN(C(=O)/C/1=C\N)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 274.28
Empirical Formula: C13H14N4O3

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 1.237
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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