COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444670
Chemical Name: (4Z)-1-(3,5-dichlorophenyl)-4-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]pyrazolidine-3,5-dione
Smiles: C#CCOc1ccc(cc1OCC)/C=C\1/C(=O)NN(C1=O)c1cc(Cl)cc(c1)Cl

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Molecular Weight: 431.27
Empirical Formula: C21H16Cl2N2O4

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 4.772
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 3

     

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