COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219813
Chemical Name: 4-[(4Z)-3-methyl-4-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1N=C(/C(=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])/C1=O)C

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Molecular Weight: 416.39
Empirical Formula: C22H16N4O5

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 3.581
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 120
Number of rings: 4

     

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