COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK868330
Chemical Name: (4E)-5-methyl-4-[(morpholin-4-ylamino)methylidene]-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/NN1CCOCC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 331.33
Empirical Formula: C15H17N5O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.397
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 102
Number of rings: 3

     

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