COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432742
Chemical Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(3-chlorophenyl)pyrazolidine-3,5-dione
Smiles: Clc1cccc(c1)N1NC(=O)/C(=C\c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 342.74
Empirical Formula: C17H11ClN2O4

Physical State: Dry powder
Available Amount: 43 mg

Lipinsky:
logP: 3.89
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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