COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK816718
Chemical Name: (4E)-4-[(2-methyl-2H-chromen-3-yl)methylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)SCC1=NN(C(=O)/C/1=C/C1=Cc2ccccc2OC1C)c1ccccc1

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Molecular Weight: 452.58
Empirical Formula: C28H24N2O2S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 6.705
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 67
Number of rings: 5

     

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