COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL036476
Chemical Name: 3-({(E)-[3-(4-methylphenyl)-1H-pyrazol-4-yl]methylidene}amino)-2-[({[(1E)-1-phenylethylidene]amino}oxy)methyl]quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)c1n[nH]cc1/C=N/n1c(CO/N=C(/c2ccccc2)\C)nc2c(c1=O)cccc2

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Molecular Weight: 476.54
Empirical Formula: C28H24N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.265
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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