COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206738
Chemical Name: (4E)-5-methyl-2-(4-nitrophenyl)-4-({[3-(propan-2-yloxy)propyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC(OCCCN/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C)C

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Molecular Weight: 346.39
Empirical Formula: C17H22N4O4

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 1.703
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 2

     

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