COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507622
Chemical Name: (2-{(Z)-[1-(3-chloro-4-methylphenyl)-3-hydroxy-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-6-methoxyphenoxy)acetonitrile
Smiles: N#CCOc1c(cccc1OC)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)Cl)C)O

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Molecular Weight: 397.82
Empirical Formula: C20H16ClN3O4

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 3.815
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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