COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511985
Chemical Name: (4Z)-4-{[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-5-hydroxy-2-(3-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1cccc(c1)N1N=C(/C(=C/c2cccn2c2ccc(c(c2)[N+](=O)[O-])Cl)/C1=O)O

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Molecular Weight: 422.83
Empirical Formula: C21H15ClN4O4

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.623
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 4

     

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