COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834446
Chemical Name: (4E)-4-(4-hydroxy-3-methoxybenzylidene)-5-(morpholin-4-yl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(ccc1O)/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])N1CCOCC1

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Molecular Weight: 424.41
Empirical Formula: C21H20N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.278
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 120
Number of rings: 4

     

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