COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK957024
Chemical Name: 4-[(E)-{[3-(1H-imidazol-1-yl)propyl]imino}methyl]-5-methyl-2-(4-nitrophenyl)-1,2-dihydro-3H-pyrazol-3-one
Smiles: [O-][N+](=O)c1ccc(cc1)n1[nH]c(c(c1=O)/C=N/CCCn1cncc1)C

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Molecular Weight: 354.37
Empirical Formula: C17H18N6O3

Physical State: Dry powder
Available Amount: 28 mg

Lipinsky:
logP: 1.816
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 3

     

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