COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741973
Chemical Name: (4Z)-5-methyl-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCCCCN/C(=C\1/C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C)/C

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Molecular Weight: 330.39
Empirical Formula: C17H22N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.275
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 2

     

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