COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706549
Chemical Name: (4Z)-5-{[(4-methylphenyl)sulfanyl]methyl}-2-phenyl-4-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCCOc1ccc(cc1)c1nn(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)CSc1ccc(cc1)C)c1ccccc1

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Molecular Weight: 584.74
Empirical Formula: C36H32N4O2S

Physical State: Dry powder
Available Amount: 406 mg

Lipinsky:
logP: 9.118
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 85
Number of rings: 6

     

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