COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443452
Chemical Name: (4-{(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenoxy)acetonitrile
Smiles: N#CCOc1ccc(cc1OC)/C=C\1/C(=NN(C1=O)c1ccc(cc1)Cl)C

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Molecular Weight: 381.82
Empirical Formula: C20H16ClN3O3

Physical State: Dry powder
Available Amount: 537 mg

Lipinsky:
logP: 3.424
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 3

     

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