COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006258
Chemical Name: 4-[(E)-({2-[4-(cyclopropylcarbonyl)piperazin-1-yl]ethyl}imino)methyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: O=C(N1CCN(CC1)CC/N=C/c1c([nH]n(c1=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1)C1CC1

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Molecular Weight: 488.55
Empirical Formula: C26H28N6O4

Available Amount: 0 mg

Lipinsky:
logP: 2.653
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 5

     

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