COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432707
Chemical Name: methyl4-{(4Z)-4-[3-methoxy-4-(2-phenylethoxy)benzylidene]-3,5-dioxopyrazolidin-1-yl}benzoate
Smiles: COc1cc(ccc1OCCc1ccccc1)/C=C\1/C(=O)NN(C1=O)c1ccc(cc1)C(=O)OC

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Molecular Weight: 472.5
Empirical Formula: C27H24N2O6

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 4.858
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 94
Number of rings: 4

     

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