COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK820773
Chemical Name: S-{1-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxo-3-phenylpropyl}ethanethioate
Smiles: Cc1ccc(cc1)c1nn(cc1C(CC(=O)c1ccccc1)SC(=O)C)c1ccccc1

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Molecular Weight: 440.57
Empirical Formula: C27H24N2O2S

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 6.757
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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