COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143109
Chemical Name: (4Z)-5-(4-methoxyphenyl)-4-{[(4-methoxyphenyl)amino]methylidene}-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)C1=NN(C(=O)/C/1=C\Nc1ccc(cc1)OC)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: HCl
Molecular Weight: 444.45
Empirical Formula: C24H20N4O5

Physical State: Dry powder
Available Amount: 467 mg

Lipinsky:
logP: 2.875
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 4

     

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