COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051731
Chemical Name: 4-({2-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}methyl)benzoicacid
Smiles: COc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C/1\C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 442.47
Empirical Formula: C26H22N2O5

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: 4.472
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 88
Number of rings: 4

     

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